Mesoionic Compounds in AKos Samples
| AKOS_NUMBER | MOLWEIGHT | MOLFORMULA | INCHIKEY | INCHI | SMILES | MDLNUMBER |
| AKOS005219534 | 238.263 | C10 H10 N2 O3 S | ZTEPCHWHTSPDPN-UHFFFAOYSA-N | InChI=1S/C10H10N2O3S/c1-14-8-5-3-7(4-6-8)12-9(16-2)10(13)15-11-12/h3-6H,1-2H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])SC | |
| AKOS005219728 | 222.197 | C10 H10 N2 O4 | SFWOVEPTDHBNHA-UHFFFAOYSA-N | InChI=1S/C10H10N2O4/c1-15-8-4-2-7(3-5-8)12-9(6-13)10(14)16-11-12/h2-5,13H,6H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CO | |
| AKOS005219550 | 254.262 | C10 H10 N2 O4 S | JDEQYCUQJUQVLO-UHFFFAOYSA-N | InChI=1S/C10H10N2O4S/c1-12-9(10(14)16-11-12)8(13)6-17-5-7-3-2-4-15-7/h2-4H,5-6H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSCc2ccco2 | |
| AKOS005219756 | 218.212 | C10 H10 N4 O2 | MIPWCUNCKCTMLV-UHFFFAOYSA-O | InChI=1S/C10H9N4O2/c1-14-9(10(15)16-13-14)7-11-12-8-5-3-2-4-6-8/h2-7H,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=N/Nc2ccccc2 | |
| AKOS005252418 | 250.277 | C10 H10 N4 O2 S | ZUZDGWQBWVFHMD-UHFFFAOYSA-N | InChI=1S/C10H10N4O2S/c1-14-6-9(16-13-14)12-8(15)7-17-10-4-2-3-5-11-10/h2-6H,7H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2ccccn2 | |
| AKOS005250548 | 298.275 | C10 H10 N4 O5 S | TYXOXTKKHIMSSS-UHFFFAOYSA-N | InChI=1S/C10H10N4O5S/c1-14-8(10(16)19-13-14)9(15)12-6-2-4-7(5-3-6)20(11,17)18/h2-5H,1H3,(H3-,11,12,13,15,16,17,18) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)S(=O)(=O)N | |
| AKOS005215619 | 324.213 | C10 H11 F3 N4 O5 | APPQZYHNQXUJPW-UHFFFAOYSA-N | InChI=1S/C10H11F3N4O5/c1-20-8(18)6-7(14-9(19)10(11,12)13)22-15-17(6)16-2-4-21-5-3-16/h2-5H2,1H3 | COC(=O)c1c(on[n+]1N2CCOCC2)[N-]C(=O)C(F)(F)F | |
| AKOS005214220 | 205.213 | C10 H11 N3 O2 | FBBYJCDLIRYFQS-UHFFFAOYSA-N | InChI=1S/C10H11N3O2/c1-7-2-4-8(5-3-7)13-9(6-11)10(14)15-12-13/h2-5H,6,11H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CN | |
| AKOS005219850 | 205.213 | C10 H11 N3 O2 | NUJVFICOVYOOBO-UHFFFAOYSA-N | InChI=1S/C10H11N3O2/c1-11-7-9-10(14)15-12-13(9)8-5-3-2-4-6-8/h2-6,11H,7H2,1H3 | CNCc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005214219 | 221.213 | C10 H11 N3 O3 | FFOMVKNUBOTKOE-UHFFFAOYSA-N | InChI=1S/C10H11N3O3/c1-15-8-4-2-7(3-5-8)13-9(6-11)10(14)16-12-13/h2-5H,6,11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN | |
| AKOS005250368 | 253.278 | C10 H11 N3 O3 S | FFOMOMRRLSMNML-UHFFFAOYSA-N | InChI=1S/C10H11N3O3S/c1-12(9(14)7-3-4-17-6-7)5-8-10(15)16-11-13(8)2/h3-4,6H,5H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)c2ccsc2 | |
| AKOS005250376 | 253.278 | C10 H11 N3 O3 S | WHWOZAYFCVSKOC-UHFFFAOYSA-N | InChI=1S/C10H11N3O3S/c1-12(9(14)8-4-3-5-17-8)6-7-10(15)16-11-13(7)2/h3-5H,6H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)c2cccs2 | |
| AKOS005252577 | 253.278 | C10 H11 N3 O3 S | MBEFTNDPWQOWJZ-UHFFFAOYSA-N | InChI=1S/C10H11N3O3S/c1-13-5-10(16-12-13)11-9(14)7-17-6-8-3-2-4-15-8/h2-5H,6-7H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSCc2ccco2 | |
| AKOS005250353 | 237.212 | C10 H11 N3 O4 | HGFGUVQMEABCAC-UHFFFAOYSA-N | InChI=1S/C10H11N3O4/c1-12(9(14)8-4-3-5-16-8)6-7-10(15)17-11-13(7)2/h3-5H,6H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)c2ccco2 | |
| AKOS005252504 | 265.292 | C10 H11 N5 O2 S | PQZOKOKLUFFHJZ-UHFFFAOYSA-N | InChI=1S/C10H11N5O2S/c1-2-15-6-9(17-14-15)13-8(16)7-18-10-11-4-3-5-12-10/h3-6H,2,7H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2ncccn2 | |
| AKOS005252435 | 297.29 | C10 H11 N5 O4 S | HWFXQWTYLAWYHK-UHFFFAOYSA-N | InChI=1S/C10H11N5O4S/c1-2-15-4-9(19-14-15)11-8(18)5-20-10-12-6(16)3-7(17)13-10/h3-4H,2,5H2,1H3,(H2-,11,12,13,14,16,17,18) | CC[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)O)O | |
| AKOS005215540 | 225.675 | C10 H12 N3 O . Cl | DUAACMOYGFVUSI-UHFFFAOYSA-M | InChI=1S/C10H12N3O.ClH/c1-8-2-4-9(5-3-8)6-13-7-10(11)14-12-13;/h2-5,7H,6,11H2,1H3;1H/q+1;/p-1 | Cc1ccc(cc1)C[n+]2cc(on2)N.[Cl-] | |
| AKOS005215553 | 225.675 | C10 H12 N3 O . Cl | LQLYKYOWYDQPRA-UHFFFAOYSA-M | InChI=1S/C10H12N3O.ClH/c11-10-8-13(12-14-10)7-6-9-4-2-1-3-5-9;/h1-5,8H,6-7,11H2;1H/q+1;/p-1 | c1ccc(cc1)CC[n+]2cc(on2)N.[Cl-] | |
| AKOS005215505 | 241.674 | C10 H12 N3 O2 . Cl | OOQOXYZFEPHOTN-UHFFFAOYSA-M | InChI=1S/C10H12N3O2.ClH/c1-13-9(10(11)15-12-13)7-4-3-5-8(6-7)14-2;/h3-6H,11H2,1-2H3;1H/q+1;/p-1 | C[n+]1c(c(on1)N)c2cccc(c2)OC.[Cl-] | MFCD09881677 |
| AKOS005215551 | 241.674 | C10 H12 N3 O2 . Cl | AAOCFUAPJJABEH-UHFFFAOYSA-M | InChI=1S/C10H12N3O2.ClH/c1-14-9-4-2-8(3-5-9)6-13-7-10(11)15-12-13;/h2-5,7H,6,11H2,1H3;1H/q+1;/p-1 | COc1ccc(cc1)C[n+]2cc(on2)N.[Cl-] | |
| AKOS005214300 | 220.228 | C10 H12 N4 O2 | VTEOJOTVNBWORY-UHFFFAOYSA-N | InChI=1S/C10H12N4O2/c1-14-9(10(15)16-13-14)7-12-6-8-3-2-4-11-5-8/h2-5,12H,6-7H2,1H3 | C[n+]1c(c(on1)[O-])CNCc2cccnc2 | |
| AKOS005252674 | 280.306 | C10 H12 N6 O2 S | MLLCXFDMEOAKNE-UHFFFAOYSA-N | InChI=1S/C10H12N6O2S/c1-15(2)16-6-9(18-14-16)13-8(17)7-19-10-11-4-3-5-12-10/h3-6H,7H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2ncccn2 | |
| AKOS005252679 | 312.305 | C10 H12 N6 O4 S | SWBMSPOMTCFWFP-UHFFFAOYSA-N | InChI=1S/C10H12N6O4S/c1-15(2)16-4-9(20-14-16)11-8(19)5-21-10-12-6(17)3-7(18)13-10/h3-4H,5H2,1-2H3,(H2-,11,12,13,14,17,18,19) | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)O)O | |
| AKOS005219566 | 303.358 | C10 H13 N3 O4 S2 | YMGTYOKSKVJORI-UHFFFAOYSA-N | InChI=1S/C10H13N3O4S2/c1-12-8(9(15)17-11-12)7(14)6-19-10(18)13-2-4-16-5-3-13/h2-6H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSC(=S)N2CCOCC2 | |
| AKOS005219552 | 267.308 | C10 H13 N5 O2 S | DBEVHULAEQPBKF-UHFFFAOYSA-N | InChI=1S/C10H13N5O2S/c1-3-15-6-9(17-13-15)12-8(16)7-18-10-11-4-5-14(10)2/h4-6H,3,7H2,1-2H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2nccn2C | |
| AKOS005252833 | 299.373 | C10 H13 N5 O2 S2 | ASMQEKFXDWJGAA-UHFFFAOYSA-N | InChI=1S/C10H13N5O2S2/c1-6(2)15-4-9(17-14-15)11-8(16)5-18-10-13-12-7(3)19-10/h4,6H,5H2,1-3H3 | Cc1nnc(s1)SCC(=O)[N-]c2c[n+](no2)C(C)C | |
| AKOS005253410 | 315.372 | C10 H13 N5 O3 S2 | JZDYZCJABADPOC-UHFFFAOYSA-N | InChI=1S/C10H13N5O3S2/c1-7-12-13-10(20-7)19-6-8(16)11-9-5-15(14-18-9)3-4-17-2/h5H,3-4,6H2,1-2H3 | Cc1nnc(s1)SCC(=O)[N-]c2c[n+](no2)CCOC | |
| AKOS005252514 | 295.321 | C10 H13 N7 O2 S | SSRREHNMJCRRMX-UHFFFAOYSA-N | InChI=1S/C10H13N7O2S/c1-2-17-4-9(19-16-17)15-8(18)5-20-10-13-6(11)3-7(12)14-10/h3-4H,2,5H2,1H3,(H4-,11,12,13,14,15,16,18) | CC[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)N)N | |
| AKOS005252827 | 295.321 | C10 H13 N7 O2 S | RNPDZJLZHQLUBC-UHFFFAOYSA-N | InChI=1S/C10H13N7O2S/c1-6(2)17-3-8(19-16-17)14-7(18)4-20-10-13-5-12-9(11)15-10/h3,5-6H,4H2,1-2H3,(H2-,11,12,13,14,15,16,18) | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2ncnc(n2)N | |
| AKOS005253398 | 311.32 | C10 H13 N7 O3 S | ZNUZYIJLXHEJGQ-UHFFFAOYSA-N | InChI=1S/C10H13N7O3S/c1-19-3-2-17-4-8(20-16-17)14-7(18)5-21-10-13-6-12-9(11)15-10/h4,6H,2-3,5H2,1H3,(H2-,11,12,13,14,15,16,18) | COCC[n+]1cc(on1)[N-]C(=O)CSc2ncnc(n2)N | |
| AKOS005252937 | 343.385 | C10 H13 N7 O3 S2 | OZSDUEISAAUWFY-UHFFFAOYSA-N | InChI=1S/C10H13N7O3S2/c11-9-13-14-10(22-9)21-6-7(18)12-8-5-17(15-20-8)16-1-3-19-4-2-16/h5H,1-4,6H2,(H2-,11,12,13,15,18) | c1c(on[n+]1N2CCOCC2)[N-]C(=O)CSc3nnc(s3)N | |
| AKOS005215517 | 288.141 | C10 H14 Br N3 O2 | BACNLGMVMXCDPC-UHFFFAOYSA-N | InChI=1S/C10H14BrN3O2/c11-6-9(15)12-10-7-14(13-16-10)8-4-2-1-3-5-8/h7-8H,1-6H2 | c1c(on[n+]1C2CCCCC2)[N-]C(=O)CBr | |
| AKOS005215669 | 243.69 | C10 H14 Cl N3 O2 | BYQUTGIJQMQQKN-UHFFFAOYSA-N | InChI=1S/C10H14ClN3O2/c11-6-9(15)12-10-7-14(13-16-10)8-4-2-1-3-5-8/h7-8H,1-6H2 | c1c(on[n+]1C2CCCCC2)[N-]C(=O)CCl | |
| AKOS005252832 | 286.374 | C10 H14 N4 O2 S2 | CWXLXPURLFEEGC-UHFFFAOYSA-N | InChI=1S/C10H14N4O2S2/c1-7(2)14-5-9(16-13-14)12-8(15)6-18-10-11-3-4-17-10/h5,7H,3-4,6H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=NCCS2 | |
| AKOS005215651 | 238.243 | C10 H14 N4 O3 | HDHMAGCWVHOVER-UHFFFAOYSA-N | InChI=1S/C10H14N4O3/c1-8(16)11-10-9(7-15)14(12-17-10)13-5-3-2-4-6-13/h7H,2-6H2,1H3 | CC(=O)[N-]c1c([n+](no1)N2CCCCC2)C=O | |
| AKOS005253409 | 302.373 | C10 H14 N4 O3 S2 | IMSLSGAJJUGXLD-UHFFFAOYSA-N | InChI=1S/C10H14N4O3S2/c1-16-4-3-14-6-9(17-13-14)12-8(15)7-19-10-11-2-5-18-10/h6H,2-5,7H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSC2=NCCS2 | |
| AKOS005214874 | 254.243 | C10 H14 N4 O4 | VYLKPGJZMUWOOY-UHFFFAOYSA-N | InChI=1S/C10H14N4O4/c1-7(15)9-10(11-8(2)16)18-12-14(9)13-3-5-17-6-4-13/h3-6H2,1-2H3 | CC(=O)c1c(on[n+]1N2CCOCC2)[N-]C(=O)C | |
| AKOS005219458 | 282.322 | C10 H14 N6 O2 S | OFYNMIXVPLNHEB-UHFFFAOYSA-N | InChI=1S/C10H14N6O2S/c1-7(2)16-4-9(18-14-16)12-8(17)5-19-10-13-11-6-15(10)3/h4,6-7H,5H2,1-3H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nncn2C | |
| AKOS005252673 | 282.322 | C10 H14 N6 O2 S | FWNUQQGPAILQLO-UHFFFAOYSA-N | InChI=1S/C10H14N6O2S/c1-14(2)16-6-9(18-13-16)12-8(17)7-19-10-11-4-5-15(10)3/h4-6H,7H2,1-3H3 | Cn1ccnc1SCC(=O)[N-]c2c[n+](no2)N(C)C | |
| AKOS005252678 | 310.336 | C10 H14 N8 O2 S | UKCMCHIPUCCSRC-UHFFFAOYSA-N | InChI=1S/C10H14N8O2S/c1-17(2)18-4-9(20-16-18)15-8(19)5-21-10-13-6(11)3-7(12)14-10/h3-4H,5H2,1-2H3,(H4-,11,12,13,14,15,16,19) | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)N)N | |
| AKOS005214962 | 258.705 | C10 H15 Cl N4 O2 | IBTPSDHEDPEMGD-UHFFFAOYSA-N | InChI=1S/C10H15ClN4O2/c1-8(16)12-10-9(7-11)15(13-17-10)14-5-3-2-4-6-14/h2-7H2,1H3 | CC(=O)[N-]c1c([n+](no1)N2CCCCC2)CCl | |
| AKOS005215709 | 274.704 | C10 H15 Cl N4 O3 | OHELCGWWJSCLCW-UHFFFAOYSA-N | InChI=1S/C10H15ClN4O3/c11-7-9(16)12-10-8-15(13-18-10)2-1-14-3-5-17-6-4-14/h8H,1-7H2 | c1c(on[n+]1CCN2CCOCC2)[N-]C(=O)CCl | |
| AKOS005215737 | 209.245 | C10 H15 N3 O2 | IYGGSYLXFDKOFN-UHFFFAOYSA-N | InChI=1S/C10H15N3O2/c1-8(14)11-10-7-13(12-15-10)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3 | CC(=O)[N-]c1c[n+](no1)C2CCCCC2 | MFCD00452403 |
| AKOS005215590 | 225.244 | C10 H15 N3 O3 | KLPDZHNPAGNHKA-UHFFFAOYSA-N | InChI=1S/C10H15N3O3/c1-10(2,3)15-9(14)11-8-6-13(12-16-8)7-4-5-7/h6-7H,4-5H2,1-3H3 | CC(C)(C)OC(=O)[N-]c1c[n+](no1)C2CC2 | |
| AKOS005215641 | 225.244 | C10 H15 N3 O3 | QKPDAALXIFRNMY-UHFFFAOYSA-N | InChI=1S/C10H15N3O3/c1-5-6-13-7-8(16-12-13)11-9(14)15-10(2,3)4/h5,7H,1,6H2,2-4H3 | CC(C)(C)OC(=O)[N-]c1c[n+](no1)CC=C | |
| AKOS005250367 | 225.244 | C10 H15 N3 O3 | LAFZOBWUUMOOGB-UHFFFAOYSA-N | InChI=1S/C10H15N3O3/c1-12(9(14)7-4-3-5-7)6-8-10(15)16-11-13(8)2/h7H,3-6H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)C2CCC2 | |
| AKOS005219473 | 257.243 | C10 H15 N3 O5 | VXVRDXGWMALHRE-UHFFFAOYSA-N | InChI=1S/C10H15N3O5/c1-5-13-7(6-14)8(17-12-13)11-18-9(15)16-10(2,3)4/h6H,5H2,1-4H3 | CC[n+]1c(c(on1)[N-]OC(=O)OC(C)(C)C)C=O | |
| AKOS005214909 | 240.259 | C10 H16 N4 O3 | CJGVVIRGJMEYSS-UHFFFAOYSA-N | InChI=1S/C10H16N4O3/c1-8(16)11-10-9(7-15)14(12-17-10)13-5-3-2-4-6-13/h15H,2-7H2,1H3 | CC(=O)[N-]c1c([n+](no1)N2CCCCC2)CO | |
| AKOS005215568 | 240.259 | C10 H16 N4 O3 | ZIAUIQOJLYSFGL-UHFFFAOYSA-N | InChI=1S/C10H16N4O3/c1-9(15)11-10-8-14(12-17-10)3-2-13-4-6-16-7-5-13/h8H,2-7H2,1H3 | CC(=O)[N-]c1c[n+](no1)CCN2CCOCC2 | |
| AKOS005215012 | 256.258 | C10 H16 N4 O4 | CVKFRZHNMGIKRB-UHFFFAOYSA-N | InChI=1S/C10H16N4O4/c1-7(15)9-10(11-8(2)16)18-12-14(9)13-3-5-17-6-4-13/h7,15H,3-6H2,1-2H3 | CC(c1c(on[n+]1N2CCOCC2)[N-]C(=O)C)O | |
| AKOS005214239 | 211.261 | C10 H17 N3 O2 | PANUZPWIAFCUSW-UHFFFAOYSA-N | InChI=1S/C10H17N3O2/c1-13-9(10(14)15-12-13)7-11-8-5-3-2-4-6-8/h8,11H,2-7H2,1H3 | C[n+]1c(c(on1)[O-])CNC2CCCCC2 | |
| AKOS005219479 | 211.261 | C10 H17 N3 O2 | CSOHHNATRLMBCT-UHFFFAOYSA-N | InChI=1S/C10H17N3O2/c1-7(2)13-6-8(15-12-13)11-9(14)10(3,4)5/h6-7H,1-5H3 | CC(C)[n+]1cc(on1)[N-]C(=O)C(C)(C)C | |
| AKOS005215565 | 227.26 | C10 H17 N3 O3 | NTHTYLYTLNKACV-UHFFFAOYSA-N | InChI=1S/C10H17N3O3/c1-7(2)13-6-8(16-12-13)11-9(14)15-10(3,4)5/h6-7H,1-5H3 | CC(C)[n+]1cc(on1)[N-]C(=O)OC(C)(C)C | |
| AKOS005250385 | 227.26 | C10 H17 N3 O3 | ALXUTTFEIICCHH-UHFFFAOYSA-N | InChI=1S/C10H17N3O3/c1-4-5-6-9(14)12(2)7-8-10(15)16-11-13(8)3/h4-7H2,1-3H3 | CCCCC(=O)N(C)Cc1c(on[n+]1C)[O-] | |
| AKOS005219462 | 243.26 | C10 H17 N3 O4 | NORPDCXKMPSPMO-UHFFFAOYSA-N | InChI=1S/C10H17N3O4/c1-7(2)13-6-8(16-12-13)11-17-9(14)15-10(3,4)5/h6-7H,1-5H3 | CC(C)[n+]1cc(on1)[N-]OC(=O)OC(C)(C)C | |
| AKOS005215048 | 239.274 | C10 H17 N5 O2 | DVWNUBLFBOJJRM-UHFFFAOYSA-N | InChI=1S/C10H17N5O2/c1-8(16)12-10-9(7-11)15(13-17-10)14-5-3-2-4-6-14/h2-7,11H2,1H3 | CC(=O)[N-]c1c([n+](no1)N2CCCCC2)CN | |
| AKOS005214931 | 255.274 | C10 H17 N5 O3 | JQCQFMARNMDXDZ-UHFFFAOYSA-N | InChI=1S/C10H17N5O3/c1-8(16)12-10-9(7-11-2)15(13-18-10)14-3-5-17-6-4-14/h11H,3-7H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)N2CCOCC2)CNC | |
| AKOS005214301 | 242.275 | C10 H18 N4 O3 | HJZYDDKGKPBKIH-UHFFFAOYSA-N | InChI=1S/C10H18N4O3/c1-13-9(10(15)17-12-13)8-11-2-3-14-4-6-16-7-5-14/h11H,2-8H2,1H3 | C[n+]1c(c(on1)[O-])CNCCN2CCOCC2 | |
| AKOS005214303 | 242.275 | C10 H18 N4 O3 | PQMVNQLYHUGOEH-UHFFFAOYSA-N | InChI=1S/C10H18N4O3/c1-8(2)14-9(10(15)17-12-14)7-11-13-3-5-16-6-4-13/h8,11H,3-7H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNN2CCOCC2 | |
| AKOS005214244 | 213.277 | C10 H19 N3 O2 | MDYVULBGGZOHOF-UHFFFAOYSA-N | InChI=1S/C10H19N3O2/c1-5-8(4)11-6-9-10(14)15-12-13(9)7(2)3/h7-8,11H,5-6H2,1-4H3 | CCC(C)NCc1c(on[n+]1C(C)C)[O-] | |
| AKOS005214245 | 213.277 | C10 H19 N3 O2 | CSBPBPMDHWKFCJ-UHFFFAOYSA-N | InChI=1S/C10H19N3O2/c1-7(2)13-8(9(14)15-12-13)6-11-10(3,4)5/h7,11H,6H2,1-5H3 | CC(C)[n+]1c(c(on1)[O-])CNC(C)(C)C | |
| AKOS005214317 | 229.276 | C10 H19 N3 O3 | ARLPDIVFJOHBNJ-UHFFFAOYSA-N | InChI=1S/C10H19N3O3/c1-8(2)13-9(10(14)16-12-13)7-11-5-4-6-15-3/h8,11H,4-7H2,1-3H3 | CC(C)[n+]1c(c(on1)[O-])CNCCCOC | |
| AKOS005214267 | 245.276 | C10 H19 N3 O4 | VQIYUZBIJRSQAP-UHFFFAOYSA-N | InChI=1S/C10H19N3O4/c1-7(2)13-8(10(14)17-12-13)5-11-6-9(15-3)16-4/h7,9,11H,5-6H2,1-4H3 | CC(C)[n+]1c(c(on1)[O-])CNCC(OC)OC | |
| AKOS005214305 | 228.291 | C10 H20 N4 O2 | YANDEPAZBYLOHY-UHFFFAOYSA-N | InChI=1S/C10H20N4O2/c1-8(2)14-9(10(15)16-12-14)7-11-5-6-13(3)4/h8,11H,5-7H2,1-4H3 | CC(C)[n+]1c(c(on1)[O-])CNCCN(C)C | |
| AKOS005215715 | 316.132 | C10 H3 F7 N2 O2 | GZLLOUMJOQNIOJ-UHFFFAOYSA-N | InChI=1S/C10H3F7N2O2/c1-19-8(9(20)21-18-19)2-4(11)6(13)3(10(15,16)17)7(14)5(2)12/h1H3 | C[n+]1c(c(on1)[O-])c2c(c(c(c(c2F)F)C(F)(F)F)F)F | |
| AKOS005250549 | 291.159 | C10 H5 F4 N3 O3 | HKEPWASSBQDAKD-UHFFFAOYSA-N | InChI=1S/C10H5F4N3O3/c1-17-8(10(19)20-16-17)9(18)15-7-5(13)3(11)2-4(12)6(7)14/h2H,1H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])C(=O)Nc2c(c(cc(c2F)F)F)F | |
| AKOS005250635 | 316.083 | C10 H7 Br F N3 O3 | FVWKDBBWDKSETH-UHFFFAOYSA-N | InChI=1S/C10H7BrFN3O3/c1-15-8(10(17)18-14-15)9(16)13-7-3-2-5(11)4-6(7)12/h2-4H,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2F)Br | |
| AKOS005250647 | 271.632 | C10 H7 Cl F N3 O3 | XMUSUHVYFYXFKX-UHFFFAOYSA-N | InChI=1S/C10H7ClFN3O3/c1-15-8(10(17)18-14-15)9(16)13-5-2-3-7(12)6(11)4-5/h2-4H,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(c(c2)Cl)F | |
| AKOS005250508 | 288.087 | C10 H7 Cl2 N3 O3 | QJLKFWVTGPJKSK-UHFFFAOYSA-N | InChI=1S/C10H7Cl2N3O3/c1-15-8(10(17)18-14-15)9(16)13-7-3-2-5(11)4-6(7)12/h2-4H,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2Cl)Cl | |
| AKOS005250509 | 288.087 | C10 H7 Cl2 N3 O3 | NNLIINMKZDXIGB-UHFFFAOYSA-N | InChI=1S/C10H7Cl2N3O3/c1-15-8(10(17)18-14-15)9(16)13-7-4-5(11)2-3-6(7)12/h2-4H,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])C(=O)Nc2cc(ccc2Cl)Cl | |
| AKOS005250510 | 288.087 | C10 H7 Cl2 N3 O3 | DJLSLYPVXAAOAB-UHFFFAOYSA-N | InChI=1S/C10H7Cl2N3O3/c1-15-8(10(17)18-14-15)9(16)13-5-2-3-6(11)7(12)4-5/h2-4H,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(c(c2)Cl)Cl | |
| AKOS005250637 | 288.087 | C10 H7 Cl2 N3 O3 | YYAMOYSULSCRKO-UHFFFAOYSA-N | InChI=1S/C10H7Cl2N3O3/c1-15-8(10(17)18-14-15)9(16)13-7-3-5(11)2-6(12)4-7/h2-4H,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])C(=O)Nc2cc(cc(c2)Cl)Cl | |
| AKOS005250659 | 288.087 | C10 H7 Cl2 N3 O3 | CPFZXOHVBVOSTB-UHFFFAOYSA-N | InChI=1S/C10H7Cl2N3O3/c1-15-8(10(17)18-14-15)9(16)13-6-4-2-3-5(11)7(6)12/h2-4H,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])C(=O)Nc2cccc(c2Cl)Cl | |
| AKOS005250595 | 255.178 | C10 H7 F2 N3 O3 | HFUREOQROQGKKZ-UHFFFAOYSA-N | InChI=1S/C10H7F2N3O3/c1-15-8(10(17)18-14-15)9(16)13-5-2-3-6(11)7(12)4-5/h2-4H,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(c(c2)F)F | |
| AKOS005251273 | 233.246 | C10 H7 N3 O2 S | ULZHGUKWFZLOLS-UHFFFAOYSA-N | InChI=1S/C10H7N3O2S/c11-6-7-16-9-10(14)15-12-13(9)8-4-2-1-3-5-8/h1-5H,7H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC#N | |
| AKOS005250660 | 263.186 | C10 H7 N4 O5 | SRYRENMCMYHIOL-UHFFFAOYSA-M | InChI=1S/C10H8N4O5/c1-13-8(10(16)19-12-13)9(15)11-6-2-4-7(5-3-6)14(17)18/h2,4-5,16H,1H3,(H,11,15)/p-1 | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(c[c-]2)[N+](=O)[O-] | |
| AKOS005250633 | 298.093 | C10 H8 Br N3 O3 | OTGWETXUMJOZIG-UHFFFAOYSA-N | InChI=1S/C10H8BrN3O3/c1-14-8(10(16)17-13-14)9(15)12-7-5-3-2-4-6(7)11/h2-5H,1H3,(H-,12,13,15,16) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2Br | |
| AKOS005250634 | 298.093 | C10 H8 Br N3 O3 | JJPWUMRKYYTZIE-UHFFFAOYSA-N | InChI=1S/C10H8BrN3O3/c1-14-8(10(16)17-13-14)9(15)12-7-4-2-6(11)3-5-7/h2-5H,1H3,(H-,12,13,15,16) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)Br | |
| AKOS005250636 | 253.642 | C10 H8 Cl N3 O3 | MSVYSJNKMTZSPG-UHFFFAOYSA-N | InChI=1S/C10H8ClN3O3/c1-14-8(10(16)17-13-14)9(15)12-7-5-3-2-4-6(7)11/h2-5H,1H3,(H-,12,13,15,16) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2Cl | |
| AKOS005250645 | 253.642 | C10 H8 Cl N3 O3 | NQODKALAIJBVGA-UHFFFAOYSA-N | InChI=1S/C10H8ClN3O3/c1-14-8(10(16)17-13-14)9(15)12-7-4-2-3-6(11)5-7/h2-5H,1H3,(H-,12,13,15,16) | C[n+]1c(c(on1)[O-])C(=O)Nc2cccc(c2)Cl | |
| AKOS005250646 | 253.642 | C10 H8 Cl N3 O3 | FFLRWQPQQDKTCI-UHFFFAOYSA-N | InChI=1S/C10H8ClN3O3/c1-14-8(10(16)17-13-14)9(15)12-7-4-2-6(11)3-5-7/h2-5H,1H3,(H-,12,13,15,16) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)Cl | |
| AKOS000280682 | 223.181 | C10 H8 F N2 O3 | OJZPUFJZDYUNIG-UHFFFAOYSA-O | InChI=1S/C10H7FN2O3/c1-13-8(10(14)15)9(16-12-13)6-4-2-3-5-7(6)11/h2-5H,1H3/p+1 | C[n+]1c(c(on1)c2ccccc2F)C(=O)O | MFCD08694520 |
| AKOS005250528 | 237.187 | C10 H8 F N3 O3 | SVFPYPXCBJPDPL-UHFFFAOYSA-N | InChI=1S/C10H8FN3O3/c1-14-8(10(16)17-13-14)9(15)12-7-5-3-2-4-6(7)11/h2-5H,1H3,(H-,12,13,15,16) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2F | |
| AKOS005250529 | 237.187 | C10 H8 F N3 O3 | INEUDUMQRQMMHM-UHFFFAOYSA-N | InChI=1S/C10H8FN3O3/c1-14-8(10(16)17-13-14)9(15)12-7-4-2-6(11)3-5-7/h2-5H,1H3,(H-,12,13,15,16) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)F | |
| AKOS005250530 | 345.093 | C10 H8 I N3 O3 | FOEXAHFNZBEVHW-UHFFFAOYSA-N | InChI=1S/C10H8IN3O3/c1-14-8(10(16)17-13-14)9(15)12-7-4-2-6(11)3-5-7/h2-5H,1H3,(H-,12,13,15,16) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)I | |
| AKOS005214204 | 204.182 | C10 H8 N2 O3 | ZUKPVIQHOHMWDM-UHFFFAOYSA-N | InChI=1S/C10H8N2O3/c1-7-2-4-8(5-3-7)12-9(6-13)10(14)15-11-12/h2-6H,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])C=O | |
| AKOS005215648 | 204.182 | C10 H8 N2 O3 | SLCBVFPDMGNJOZ-UHFFFAOYSA-N | InChI=1S/C10H8N2O3/c1-7(13)9-10(14)15-11-12(9)8-5-3-2-4-6-8/h2-6H,1H3 | CC(=O)c1c(on[n+]1c2ccccc2)[O-] | MFCD09881655 |
| AKOS005214203 | 220.182 | C10 H8 N2 O4 | RHCYELMUONTNJP-UHFFFAOYSA-N | InChI=1S/C10H8N2O4/c1-15-8-4-2-7(3-5-8)12-9(6-13)10(14)16-11-12/h2-6H,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C=O | |
| AKOS005251320 | 252.247 | C10 H8 N2 O4 S | JKPTWASJOMXVFK-UHFFFAOYSA-N | InChI=1S/C10H8N2O4S/c13-8(14)6-17-9-10(15)16-11-12(9)7-4-2-1-3-5-7/h1-5H,6H2,(H-,11,13,14,15) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)O | |
| AKOS005219727 | 236.181 | C10 H8 N2 O5 | QUFBARNXKRRKPJ-UHFFFAOYSA-N | InChI=1S/C10H8N2O5/c1-16-7-4-2-6(3-5-7)12-8(9(13)14)10(15)17-11-12/h2-5H,1H3,(H-,11,13,14,15) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)O | |
| AKOS005215698 | 276.275 | C10 H8 N6 O2 S | MOGPRXSHQMVLOZ-UHFFFAOYSA-N | InChI=1S/C10H8N6O2S/c1-16-7(10(17)18-15-16)6-4(2-11)8(13)19-9(14)5(6)3-12/h6H,13-14H2,1H3 | C[n+]1c(c(on1)[O-])C2C(=C(SC(=C2C#N)N)N)C#N | |
| AKOS005215474 | 203.197 | C10 H9 N3 O2 | GKNQWAQZDMCMEM-UHFFFAOYSA-N | InChI=1S/C10H9N3O2/c1-13-7-9(15-12-13)11-10(14)8-5-3-2-4-6-8/h2-7H,1H3 | C[n+]1cc(on1)[N-]C(=O)c2ccccc2 | |
| AKOS005215602 | 203.197 | C10 H9 N3 O2 | ZFACQJOTKFZKCY-UHFFFAOYSA-N | InChI=1S/C10H9N3O2/c1-8(14)11-10-7-13(12-15-10)9-5-3-2-4-6-9/h2-7H,1H3 | CC(=O)[N-]c1c[n+](no1)c2ccccc2 | MFCD08488685 |
| AKOS005250505 | 219.197 | C10 H9 N3 O3 | GELWLGNXKVHWBD-UHFFFAOYSA-N | InChI=1S/C10H9N3O3/c1-13-8(10(15)16-12-13)9(14)11-7-5-3-2-4-6-7/h2-6H,1H3,(H-,11,12,14,15) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2 | |
| AKOS005250707 | 251.262 | C10 H9 N3 O3 S | SFSUDFNDTVRBCJ-UHFFFAOYSA-N | InChI=1S/C10H9N3O3S/c1-13-9(10(15)16-12-13)7(14)6-17-8-4-2-3-5-11-8/h2-5H,6H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2ccccn2 | |
| AKOS005251322 | 251.262 | C10 H9 N3 O3 S | XWXLWLOMMKZFCI-UHFFFAOYSA-N | InChI=1S/C10H9N3O3S/c11-8(14)6-17-9-10(15)16-12-13(9)7-4-2-1-3-5-7/h1-5H,6H2,(H2-,11,12,14,15) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)N | |
| AKOS005219834 | 263.276 | C10 H9 N5 O2 S | RGFILBNUEPJOGB-UHFFFAOYSA-O | InChI=1S/C10H8N5O2S/c11-10(18)13-12-6-8-9(16)17-14-15(8)7-4-2-1-3-5-7/h1-6H,(H2,11,18)/q-1/p+1 | c1ccc(cc1)[n+]2c(c(on2)[O-])/C=N/NC(=S)N | |
| AKOS005251323 | 344.184 | C11 H10 Br N3 O3 S | RWLGCEQNYWJUSL-UHFFFAOYSA-N | InChI=1S/C11H10BrN3O3S/c1-15-10(11(17)18-14-15)19-6-9(16)13-8-5-3-2-4-7(8)12/h2-5H,6H2,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccccc2Br | |
| AKOS005251324 | 344.184 | C11 H10 Br N3 O3 S | CMKHYPISOLTVDP-UHFFFAOYSA-N | InChI=1S/C11H10BrN3O3S/c1-15-10(11(17)18-14-15)19-6-9(16)13-8-4-2-7(12)3-5-8/h2-5H,6H2,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)Br | |
| AKOS005215555 | 251.669 | C11 H10 Cl N3 O2 | NFHSXEFRDWAMOX-UHFFFAOYSA-N | InChI=1S/C11H10ClN3O2/c1-8(16)13-11-7-15(14-17-11)6-9-4-2-3-5-10(9)12/h2-5,7H,6H2,1H3 | CC(=O)[N-]c1c[n+](no1)Cc2ccccc2Cl | |
| AKOS005215670 | 251.669 | C11 H10 Cl N3 O2 | BFFQYUKDDONXLG-UHFFFAOYSA-N | InChI=1S/C11H10ClN3O2/c12-6-10(16)13-11-8-15(14-17-11)7-9-4-2-1-3-5-9/h1-5,8H,6-7H2 | c1ccc(cc1)C[n+]2cc(on2)[N-]C(=O)CCl | |
| AKOS005252640 | 283.734 | C11 H10 Cl N3 O2 S | KEGKKVJXBQJMDC-UHFFFAOYSA-N | InChI=1S/C11H10ClN3O2S/c1-15-6-11(17-14-15)13-10(16)7-18-9-4-2-8(12)3-5-9/h2-6H,7H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2ccc(cc2)Cl | |
| AKOS005250648 | 267.668 | C11 H10 Cl N3 O3 | UXYQSDDHAZOFMA-UHFFFAOYSA-N | InChI=1S/C11H10ClN3O3/c1-6-7(12)4-3-5-8(6)13-10(16)9-11(17)18-14-15(9)2/h3-5H,1-2H3,(H-,13,14,16,17) | Cc1c(cccc1Cl)NC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005250657 | 267.668 | C11 H10 Cl N3 O3 | LHFOHTLPSSSBDS-UHFFFAOYSA-N | InChI=1S/C11H10ClN3O3/c1-6-3-4-7(5-8(6)12)13-10(16)9-11(17)18-14-15(9)2/h3-5H,1-2H3,(H-,13,14,16,17) | Cc1ccc(cc1Cl)NC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005250658 | 267.668 | C11 H10 Cl N3 O3 | HKZNWRGDAGNYBS-UHFFFAOYSA-N | InChI=1S/C11H10ClN3O3/c1-6-3-4-7(12)5-8(6)13-10(16)9-11(17)18-14-15(9)2/h3-5H,1-2H3,(H-,13,14,16,17) | Cc1ccc(cc1NC(=O)c2c(on[n+]2C)[O-])Cl | |
| AKOS005251350 | 299.733 | C11 H10 Cl N3 O3 S | TUZIUPMPUOPDPK-UHFFFAOYSA-N | InChI=1S/C11H10ClN3O3S/c1-15-10(11(17)18-14-15)19-6-9(16)13-8-5-3-2-4-7(8)12/h2-5H,6H2,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccccc2Cl | |
| AKOS005251351 | 299.733 | C11 H10 Cl N3 O3 S | WLMIZBLFBACNRV-UHFFFAOYSA-N | InChI=1S/C11H10ClN3O3S/c1-15-10(11(17)18-14-15)19-6-9(16)13-8-4-2-3-7(12)5-8/h2-5H,6H2,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2cccc(c2)Cl | |
| AKOS005251352 | 299.733 | C11 H10 Cl N3 O3 S | PGQSOUZNWBFIPE-UHFFFAOYSA-N | InChI=1S/C11H10ClN3O3S/c1-15-10(11(17)18-14-15)19-6-9(16)13-8-4-2-7(12)3-5-8/h2-5H,6H2,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)Cl | |
| AKOS005250542 | 283.668 | C11 H10 Cl N3 O4 | REWUUSRMAUXJSL-UHFFFAOYSA-N | InChI=1S/C11H10ClN3O4/c1-15-9(11(17)19-14-15)10(16)13-6-3-4-8(18-2)7(12)5-6/h3-5H,1-2H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(c(c2)Cl)OC | |
| AKOS005250543 | 283.668 | C11 H10 Cl N3 O4 | DLOXUAVYVADNER-UHFFFAOYSA-N | InChI=1S/C11H10ClN3O4/c1-15-9(11(17)19-14-15)10(16)13-7-5-6(12)3-4-8(7)18-2/h3-5H,1-2H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])C(=O)Nc2cc(ccc2OC)Cl | |
| AKOS005215542 | 235.214 | C11 H10 F N3 O2 | GHOOZJTYKMXOSW-UHFFFAOYSA-N | InChI=1S/C11H10FN3O2/c1-8(16)13-11-7-15(14-17-11)6-9-2-4-10(12)5-3-9/h2-5,7H,6H2,1H3 | CC(=O)[N-]c1c[n+](no1)Cc2ccc(cc2)F | |
| AKOS005251225 | 283.279 | C11 H10 F N3 O3 S | OCSFSMQLOJPIJJ-UHFFFAOYSA-N | InChI=1S/C11H10FN3O3S/c1-15-10(11(17)18-14-15)19-6-9(16)13-8-5-3-2-4-7(8)12/h2-5H,6H2,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccccc2F | |
| AKOS005251235 | 283.279 | C11 H10 F N3 O3 S | BSTDNPHWIJTRHM-UHFFFAOYSA-N | InChI=1S/C11H10FN3O3S/c1-15-10(11(17)18-14-15)19-6-9(16)13-8-4-2-7(12)3-5-8/h2-5H,6H2,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)F | |
| AKOS005251236 | 391.185 | C11 H10 I N3 O3 S | DXXUEDXIEULABA-UHFFFAOYSA-N | InChI=1S/C11H10IN3O3S/c1-15-10(11(17)18-14-15)19-6-9(16)13-8-4-2-7(12)3-5-8/h2-5H,6H2,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)I | |
| AKOS005219526 | 250.274 | C11 H10 N2 O3 S | FZEUSJWSUVEWRS-UHFFFAOYSA-N | InChI=1S/C11H10N2O3S/c1-13-10(11(15)16-12-13)9(14)7-17-8-5-3-2-4-6-8/h2-6H,7H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2ccccc2 | |
| AKOS005215725 | 234.208 | C11 H10 N2 O4 | NWEVGACLUMJFMD-UHFFFAOYSA-N | InChI=1S/C11H10N2O4/c1-16-9(14)7-13-10(11(15)17-12-13)8-5-3-2-4-6-8/h2-6H,7H2,1H3 | COC(=O)C[n+]1c(c(on1)[O-])c2ccccc2 | MFCD09881650 |
| AKOS005219535 | 282.272 | C11 H10 N2 O5 S | QMFOWNZSPSDXRO-UHFFFAOYSA-N | InChI=1S/C11H10N2O5S/c1-17-8-4-2-7(3-5-8)13-10(11(16)18-12-13)19-6-9(14)15/h2-5H,6H2,1H3,(H-,12,14,15,16) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)O | |
| AKOS005250557 | 262.222 | C11 H10 N4 O4 | KCLVYJNWUBXFCM-UHFFFAOYSA-N | InChI=1S/C11H10N4O4/c1-15-8(11(18)19-14-15)10(17)13-7-4-2-6(3-5-7)9(12)16/h2-5H,1H3,(H3-,12,13,14,16,17,18) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)C(=O)N | |
| AKOS005250558 | 262.222 | C11 H10 N4 O4 | OHNGXQLMBUHQJH-UHFFFAOYSA-N | InChI=1S/C11H10N4O4/c1-15-8(11(18)19-14-15)10(17)13-7-5-3-2-4-6(7)9(12)16/h2-5H,1H3,(H3-,12,13,14,16,17,18) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2C(=O)N | |
| AKOS005250532 | 278.221 | C11 H10 N4 O5 | CFTUEXSFUJDBKL-UHFFFAOYSA-N | InChI=1S/C11H10N4O5/c1-6-5-7(15(18)19)3-4-8(6)12-10(16)9-11(17)20-13-14(9)2/h3-5H,1-2H3,(H-,12,13,16,17) | Cc1cc(ccc1NC(=O)c2c(on[n+]2C)[O-])[N+](=O)[O-] | |
| AKOS005250533 | 278.221 | C11 H10 N4 O5 | GUGDQFWCSXWREF-UHFFFAOYSA-N | InChI=1S/C11H10N4O5/c1-6-3-4-7(15(18)19)5-8(6)12-10(16)9-11(17)20-13-14(9)2/h3-5H,1-2H3,(H-,12,13,16,17) | Cc1ccc(cc1NC(=O)c2c(on[n+]2C)[O-])[N+](=O)[O-] | |
| AKOS005219771 | 290.301 | C11 H10 N6 O2 S | OOZIJSBNAMMXHO-UHFFFAOYSA-N | InChI=1S/C11H10N6O2S/c12-10-13-8(14-11(20)15-10)7-9(18)19-16-17(7)6-4-2-1-3-5-6/h1-5,8H,(H4-,12,13,14,15,16,18,20) | c1ccc(cc1)[n+]2c(c(on2)[O-])C3NC(=NC(=N3)N)S | |
| AKOS005215713 | 217.224 | C11 H11 N3 O2 | FPWJFLAMLMYTID-GHXNOFRVSA-N | InChI=1S/C11H11N3O2/c1-14-10(11(15)16-13-14)8-12-7-9-5-3-2-4-6-9/h2-7H,8H2,1H3/b12-7- | C[n+]1c(c(on1)[O-])C/N=C\c2ccccc2 | |
| AKOS005215738 | 217.224 | C11 H11 N3 O2 | WSYXFQCSVWUXPZ-UHFFFAOYSA-N | InChI=1S/C11H11N3O2/c1-9(15)12-11-8-14(13-16-11)7-10-5-3-2-4-6-10/h2-6,8H,7H2,1H3 | CC(=O)[N-]c1c[n+](no1)Cc2ccccc2 | |
| AKOS005219477 | 217.224 | C11 H11 N3 O2 | PGPALZKIMQUDEV-UHFFFAOYSA-N | InChI=1S/C11H11N3O2/c1-2-14-8-10(16-13-14)12-11(15)9-6-4-3-5-7-9/h3-8H,2H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)c2ccccc2 | |
| AKOS005252603 | 249.289 | C11 H11 N3 O2 S | KLMDEOXRDGWURV-UHFFFAOYSA-N | InChI=1S/C11H11N3O2S/c1-14-7-11(16-13-14)12-10(15)8-17-9-5-3-2-4-6-9/h2-7H,8H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2ccccc2 | |
| AKOS005250661 | 233.223 | C11 H11 N3 O3 | BYWUBGRJKHTLIR-UHFFFAOYSA-N | InChI=1S/C11H11N3O3/c1-7-5-3-4-6-8(7)12-10(15)9-11(16)17-13-14(9)2/h3-6H,1-2H3,(H-,12,13,15,16) | Cc1ccccc1NC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005250662 | 233.223 | C11 H11 N3 O3 | OAWCRPLTXQZVQT-UHFFFAOYSA-N | InChI=1S/C11H11N3O3/c1-7-4-3-5-8(6-7)12-10(15)9-11(16)17-13-14(9)2/h3-6H,1-2H3,(H-,12,13,15,16) | Cc1cccc(c1)NC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005250663 | 233.223 | C11 H11 N3 O3 | NAJPNYWXEFGALI-UHFFFAOYSA-N | InChI=1S/C11H11N3O3/c1-7-3-5-8(6-4-7)12-10(15)9-11(16)17-13-14(9)2/h3-6H,1-2H3,(H-,12,13,15,16) | Cc1ccc(cc1)NC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005219533 | 265.288 | C11 H11 N3 O3 S | DUNBMSXVQYUHEF-UHFFFAOYSA-N | InChI=1S/C11H11N3O3S/c1-14-10(11(16)17-13-14)9(15)6-18-8-4-2-3-7(12)5-8/h2-5H,6,12H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2cccc(c2)N | |
| AKOS005251298 | 265.288 | C11 H11 N3 O3 S | POJNPBJPCAJMQX-UHFFFAOYSA-N | InChI=1S/C11H11N3O3S/c1-14-10(11(16)17-13-14)18-7-9(15)12-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H-,12,13,15,16) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccccc2 | |
| AKOS005250524 | 249.223 | C11 H11 N3 O4 | DMDKLWAMROJEGW-UHFFFAOYSA-N | InChI=1S/C11H11N3O4/c1-14-9(11(16)18-13-14)10(15)12-7-5-3-4-6-8(7)17-2/h3-6H,1-2H3,(H-,12,13,15,16) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2OC | |
| AKOS005250525 | 249.223 | C11 H11 N3 O4 | BZAXUZOEFXKVDC-UHFFFAOYSA-N | InChI=1S/C11H11N3O4/c1-14-9(11(16)18-13-14)10(15)12-7-4-3-5-8(6-7)17-2/h3-6H,1-2H3,(H-,12,13,15,16) | C[n+]1c(c(on1)[O-])C(=O)Nc2cccc(c2)OC | |
| AKOS005250526 | 249.223 | C11 H11 N3 O4 | HXMNXZDHCPRQQQ-UHFFFAOYSA-N | InChI=1S/C11H11N3O4/c1-14-9(11(16)18-13-14)10(15)12-7-3-5-8(17-2)6-4-7/h3-6H,1-2H3,(H-,12,13,15,16) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)OC | |
| AKOS005251265 | 281.288 | C11 H11 N3 O4 S | XXEJCEHJRCMYMP-UHFFFAOYSA-N | InChI=1S/C11H11N3O4S/c1-17-8-4-2-7(3-5-8)14-10(11(16)18-13-14)19-6-9(12)15/h2-5H,6H2,1H3,(H2-,12,13,15,16) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)N | |
| AKOS005215550 | 245.237 | C11 H11 N5 O2 | DHQBRMZASYKTSM-UHFFFAOYSA-N | InChI=1S/C11H11N5O2/c1-7(2)16-10(4-9(5-12)6-13)11(18-15-16)14-8(3)17/h4,7H,1-3H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)C)C=C(C#N)C#N | |
| AKOS005219721 | 293.302 | C11 H11 N5 O3 S | XSGJYFBHUVDJJV-UHFFFAOYSA-O | InChI=1S/C11H10N5O3S/c1-18-8-4-2-7(3-5-8)16-9(10(17)19-15-16)6-13-14-11(12)20/h2-6H,1H3,(H2,12,20)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=N/NC(=S)N | |
| AKOS005214252 | 253.685 | C11 H12 Cl N3 O2 | XAHRBWASXRFIHK-UHFFFAOYSA-N | InChI=1S/C11H12ClN3O2/c1-15-10(11(16)17-14-15)7-13-6-8-4-2-3-5-9(8)12/h2-5,13H,6-7H2,1H3 | C[n+]1c(c(on1)[O-])CNCc2ccccc2Cl | |
| AKOS005214263 | 237.23 | C11 H12 F N3 O2 | NPZUUGWAPVBPSF-UHFFFAOYSA-N | InChI=1S/C11H12FN3O2/c1-15-10(11(16)17-14-15)7-13-6-8-2-4-9(12)5-3-8/h2-5,13H,6-7H2,1H3 | C[n+]1c(c(on1)[O-])CNCc2ccc(cc2)F | |
| AKOS005215700 | 236.224 | C11 H12 N2 O4 | KFYFFTXKXMGZKY-UHFFFAOYSA-N | InChI=1S/C11H12N2O4/c1-7(14)10-11(15)17-12-13(10)8-3-5-9(16-2)6-4-8/h3-7,14H,1-2H3 | CC(c1c(on[n+]1c2ccc(cc2)OC)[O-])O | |
| AKOS005215601 | 232.239 | C11 H12 N4 O2 | YTQLQNOVEKGMRI-UHFFFAOYSA-N | InChI=1S/C11H12N4O2/c1-14(2)15-8-10(17-13-15)12-11(16)9-6-4-3-5-7-9/h3-8H,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)c2ccccc2 | |
| AKOS005252470 | 264.304 | C11 H12 N4 O2 S | FMDBQDQVKQGWEF-UHFFFAOYSA-N | InChI=1S/C11H12N4O2S/c1-15-6-11(17-14-15)13-10(16)7-18-9-4-2-3-8(12)5-9/h2-6H,7,12H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2cccc(c2)N | |
| AKOS005252799 | 264.304 | C11 H12 N4 O2 S | GCGYYFNXFIIPJA-UHFFFAOYSA-N | InChI=1S/C11H12N4O2S/c1-2-15-7-10(17-14-15)13-9(16)8-18-11-5-3-4-6-12-11/h3-7H,2,8H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2ccccn2 | |
| AKOS005250682 | 280.303 | C11 H12 N4 O3 S | BNHGXLJYLDAIHN-UHFFFAOYSA-N | InChI=1S/C11H12N4O3S/c1-6-4-7(2)13-11(12-6)19-5-8(16)9-10(17)18-14-15(9)3/h4H,5H2,1-3H3 | Cc1cc(nc(n1)SCC(=O)c2c(on[n+]2C)[O-])C | |
| AKOS005251115 | 344.367 | C11 H12 N4 O5 S2 | PBABHIXIKDVOLY-UHFFFAOYSA-N | InChI=1S/C11H12N4O5S2/c1-15-10(11(17)20-14-15)21-6-9(16)13-7-2-4-8(5-3-7)22(12,18)19/h2-5H,6H2,1H3,(H3-,12,13,14,16,17,18,19) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)S(=O)(=O)N | |
| AKOS005214288 | 219.24 | C11 H13 N3 O2 | VNWQAUIAWXFIAP-UHFFFAOYSA-N | InChI=1S/C11H13N3O2/c1-14-10(11(15)16-13-14)8-12-7-9-5-3-2-4-6-9/h2-6,12H,7-8H2,1H3 | C[n+]1c(c(on1)[O-])CNCc2ccccc2 | |
| AKOS005215610 | 255.701 | C11 H13 N3 O2 . Cl H | OMUJSCGEYOUJRW-UHFFFAOYSA-N | InChI=1S/C11H13N3O2.ClH/c1-14-10(11(15)16-13-14)8-12-7-9-5-3-2-4-6-9;/h2-6,12H,7-8H2,1H3;1H | C[n+]1c(c(on1)[O-])CNCc2ccccc2.Cl | |
| AKOS005214811 | 235.239 | C11 H13 N3 O3 | CZTDYVDYKDFWNN-UHFFFAOYSA-N | InChI=1S/C11H13N3O3/c15-7-6-12-8-10-11(16)17-13-14(10)9-4-2-1-3-5-9/h1-5,12,15H,6-8H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCCO | |
| AKOS005219453 | 235.239 | C11 H13 N3 O3 | LTPGFBFARLZLDU-UHFFFAOYSA-N | InChI=1S/C11H13N3O3/c1-12-7-10-11(15)17-13-14(10)8-3-5-9(16-2)6-4-8/h3-6,12H,7H2,1-2H3 | CNCc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005215570 | 271.7 | C11 H13 N3 O3 . Cl H | CGUIBIJYOLLPEU-UHFFFAOYSA-N | InChI=1S/C11H13N3O3.ClH/c1-12-7-10-11(15)17-13-14(10)8-3-5-9(16-2)6-4-8;/h3-6,12H,7H2,1-2H3;1H | CNCc1c(on[n+]1c2ccc(cc2)OC)[O-].Cl | |
| AKOS005251104 | 267.304 | C11 H13 N3 O3 S | VXVWRVQXZKIDDU-UHFFFAOYSA-N | InChI=1S/C11H13N3O3S/c1-14-10(11(16)17-13-14)9(15)6-18-8-4-2-7(12)3-5-8/h2,4H,3,5-6,12H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSC2=CC=C(CC2)N | |
| AKOS005252436 | 267.304 | C11 H13 N3 O3 S | SPISJYBBENXUKE-UHFFFAOYSA-N | InChI=1S/C11H13N3O3S/c1-2-14-6-11(17-13-14)12-10(15)8-18-7-9-4-3-5-16-9/h3-6H,2,7-8H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSCc2ccco2 | |
| AKOS005252638 | 279.318 | C11 H13 N5 O2 S | IGACIRIHAOESLN-UHFFFAOYSA-N | InChI=1S/C11H13N5O2S/c1-7-4-8(2)13-11(12-7)19-6-9(17)14-10-5-16(3)15-18-10/h4-5H,6H2,1-3H3 | Cc1cc(nc(n1)SCC(=O)[N-]c2c[n+](no2)C)C | |
| AKOS005252762 | 279.318 | C11 H13 N5 O2 S | VQVDSOWXJVGILN-UHFFFAOYSA-N | InChI=1S/C11H13N5O2S/c1-15(2)16-7-10(18-14-16)13-9(17)8-19-11-5-3-4-6-12-11/h3-7H,8H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2ccccn2 | |
| AKOS005252840 | 279.318 | C11 H13 N5 O2 S | DIDYUGRNYXFGTG-UHFFFAOYSA-N | InChI=1S/C11H13N5O2S/c1-8(2)16-6-10(18-15-16)14-9(17)7-19-11-12-4-3-5-13-11/h3-6,8H,7H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2ncccn2 | |
| AKOS005253418 | 295.318 | C11 H13 N5 O3 S | WEHIHXNHIOZGHT-UHFFFAOYSA-N | InChI=1S/C11H13N5O3S/c1-18-6-5-16-7-10(19-15-16)14-9(17)8-20-11-12-3-2-4-13-11/h2-4,7H,5-6,8H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2ncccn2 | |
| AKOS005252857 | 311.317 | C11 H13 N5 O4 S | LUTZZAUMJCVYQV-UHFFFAOYSA-N | InChI=1S/C11H13N5O4S/c1-6(2)16-4-10(20-15-16)12-9(19)5-21-11-13-7(17)3-8(18)14-11/h3-4,6H,5H2,1-2H3,(H2-,12,13,14,15,17,18,19) | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)O)O | |
| AKOS005253289 | 327.316 | C11 H13 N5 O5 S | YOEXZIBILDJSQA-UHFFFAOYSA-N | InChI=1S/C11H13N5O5S/c1-20-3-2-16-5-10(21-15-16)12-9(19)6-22-11-13-7(17)4-8(18)14-11/h4-5H,2-3,6H2,1H3,(H2-,12,13,14,15,17,18,19) | COCC[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)O)O | |
| AKOS005215635 | 357.016 | C11 H14 N2 O2 S Sn | CRZONVDPRQUNKE-UHFFFAOYSA-N | InChI=1S/C8H5N2O2S.3CH3.Sn/c11-8-7(13)10(9-12-8)6-4-2-1-3-5-6;;;;/h1-5H;3*1H3;/q-1;;;;+1 | C[Sn](C)(C)Sc1c(on[n+]1c2ccccc2)[O-] | MFCD09881666 |
| AKOS001582847 | 204.248 | C11 H14 N3 O | UDUSHLMWUKFPIU-UHFFFAOYSA-N | InChI=1S/C11H14N3O/c1-9(14-8-11(12)15-13-14)7-10-5-3-2-4-6-10/h2-6,8-9H,7,12H2,1H3/q+1 | CC(Cc1ccccc1)[n+]2cc(on2)N | |
| AKOS005215554 | 255.701 | C11 H14 N3 O2 . Cl | IHNNLYOLUYGGBO-UHFFFAOYSA-M | InChI=1S/C11H14N3O2.ClH/c1-15-10-5-3-2-4-9(10)6-7-14-8-11(12)16-13-14;/h2-5,8H,6-7,12H2,1H3;1H/q+1;/p-1 | COc1ccccc1CC[n+]2cc(on2)N.[Cl-] | |
| AKOS005252469 | 266.319 | C11 H14 N4 O2 S | CKMNSPGJARZMJM-UHFFFAOYSA-N | InChI=1S/C11H14N4O2S/c1-15-6-11(17-14-15)13-10(16)7-18-9-4-2-8(12)3-5-9/h2,4,6H,3,5,7,12H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSC2=CC=C(CC2)N | |
| AKOS005252680 | 282.319 | C11 H14 N4 O3 S | CCXRVDOHYBUVEN-UHFFFAOYSA-N | InChI=1S/C11H14N4O3S/c1-14(2)15-6-11(18-13-15)12-10(16)8-19-7-9-4-3-5-17-9/h3-6H,7-8H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSCc2ccco2 | |
| AKOS005253040 | 342.397 | C11 H14 N6 O3 S2 | DYOSKEOGEGHRHE-UHFFFAOYSA-N | InChI=1S/C11H14N6O3S2/c1-8-13-14-11(22-8)21-7-9(18)12-10-6-17(15-20-10)16-2-4-19-5-3-16/h6H,2-5,7H2,1H3 | Cc1nnc(s1)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3 | |
| AKOS005253030 | 338.346 | C11 H14 N8 O3 S | HWPLTQHNXSCRGH-UHFFFAOYSA-N | InChI=1S/C11H14N8O3S/c12-10-13-7-14-11(16-10)23-6-8(20)15-9-5-19(17-22-9)18-1-3-21-4-2-18/h5,7H,1-4,6H2,(H2-,12,13,14,15,16,17,20) | c1c(on[n+]1N2CCOCC2)[N-]C(=O)CSc3ncnc(n3)N | |
| AKOS005214232 | 253.321 | C11 H15 N3 O2 S | RLVMPJMFLXGRDI-UHFFFAOYSA-N | InChI=1S/C11H15N3O2S/c1-8(2)14-10(11(15)16-13-14)7-12-6-9-4-3-5-17-9/h3-5,8,12H,6-7H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCc2cccs2 | |
| AKOS005214209 | 237.255 | C11 H15 N3 O3 | QLGNKUNUJPQGRW-UHFFFAOYSA-N | InChI=1S/C11H15N3O3/c1-8(2)14-10(11(15)17-13-14)7-12-6-9-4-3-5-16-9/h3-5,8,12H,6-7H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCc2ccco2 | |
| AKOS005215666 | 237.255 | C11 H15 N3 O3 | MCJCLBXOGBVDIR-UHFFFAOYSA-N | InChI=1S/C11H15N3O3/c1-8(16)12-11-10(7-15)14(13-17-11)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3 | CC(=O)[N-]c1c([n+](no1)C2CCCCC2)C=O | |
| AKOS005251341 | 301.385 | C11 H15 N3 O3 S2 | ADBCQSMSKGQVOQ-UHFFFAOYSA-N | InChI=1S/C11H15N3O3S2/c1-13-9(10(16)17-12-13)8(15)7-19-11(18)14-5-3-2-4-6-14/h2-7H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSC(=S)N2CCCCC2 | |
| AKOS005219556 | 281.334 | C11 H15 N5 O2 S | AFJUQFUZMYVJEA-UHFFFAOYSA-N | InChI=1S/C11H15N5O2S/c1-8(2)16-6-10(18-14-16)13-9(17)7-19-11-12-4-5-15(11)3/h4-6,8H,7H2,1-3H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nccn2C | |
| AKOS005253411 | 297.334 | C11 H15 N5 O3 S | GKPJZELZLICVSU-UHFFFAOYSA-N | InChI=1S/C11H15N5O3S/c1-15-4-3-12-11(15)20-8-9(17)13-10-7-16(14-19-10)5-6-18-2/h3-4,7H,5-6,8H2,1-2H3 | Cn1ccnc1SCC(=O)[N-]c2c[n+](no2)CCOC | |
| AKOS005253039 | 329.398 | C11 H15 N5 O3 S2 | IJNZKSGHZLWCLE-UHFFFAOYSA-N | InChI=1S/C11H15N5O3S2/c17-9(8-21-11-12-1-6-20-11)13-10-7-16(14-19-10)15-2-4-18-5-3-15/h7H,1-6,8H2 | c1c(on[n+]1N2CCOCC2)[N-]C(=O)CSC3=NCCS3 | |
| AKOS005252850 | 309.348 | C11 H15 N7 O2 S | DUOXIHFRPIQFMX-UHFFFAOYSA-N | InChI=1S/C11H15N7O2S/c1-6(2)18-4-10(20-17-18)16-9(19)5-21-11-14-7(12)3-8(13)15-11/h3-4,6H,5H2,1-2H3,(H4-,12,13,14,15,16,17,19) | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)N)N | |
| AKOS005253142 | 341.412 | C11 H15 N7 O2 S2 | LLGKAXFROGPFKK-UHFFFAOYSA-N | InChI=1S/C11H15N7O2S2/c12-10-14-15-11(22-10)21-7-8(19)13-9-6-18(16-20-9)17-4-2-1-3-5-17/h6H,1-5,7H2,(H2-,12,13,14,16,19) | c1c(on[n+]1N2CCCCC2)[N-]C(=O)CSc3nnc(s3)N | |
| AKOS005253288 | 325.347 | C11 H15 N7 O3 S | NQGCTWNYQHQJLR-UHFFFAOYSA-N | InChI=1S/C11H15N7O3S/c1-20-3-2-18-5-10(21-17-18)16-9(19)6-22-11-14-7(12)4-8(13)15-11/h4-5H,2-3,6H2,1H3,(H4-,12,13,14,15,16,17,19) | COCC[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)N)N | |
| AKOS005214976 | 257.717 | C11 H16 Cl N3 O2 | SGULFFKVIMCMJC-UHFFFAOYSA-N | InChI=1S/C11H16ClN3O2/c1-8(16)13-11-10(7-12)15(14-17-11)9-5-3-2-4-6-9/h9H,2-7H2,1H3 | CC(=O)[N-]c1c([n+](no1)C2CCCCC2)CCl | |
| AKOS005215668 | 257.717 | C11 H16 Cl N3 O2 | HRFLQFYSDJVTMP-UHFFFAOYSA-N | InChI=1S/C11H16ClN3O2/c12-7-10(16)13-11-8-15(14-17-11)9-5-3-1-2-4-6-9/h8-9H,1-7H2 | c1c(on[n+]1C2CCCCCC2)[N-]C(=O)CCl | |
| AKOS005219548 | 256.321 | C11 H16 N2 O3 S | PBJLVJCRZPMAMT-UHFFFAOYSA-N | InChI=1S/C11H16N2O3S/c1-13-10(11(15)16-12-13)9(14)7-17-8-5-3-2-4-6-8/h8H,2-7H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSC2CCCCC2 | |
| AKOS005214875 | 252.27 | C11 H16 N4 O3 | JJFLFFGYPNOARQ-UHFFFAOYSA-N | InChI=1S/C11H16N4O3/c1-8(16)10-11(12-9(2)17)18-13-15(10)14-6-4-3-5-7-14/h3-7H2,1-2H3 | CC(=O)c1c(on[n+]1N2CCCCC2)[N-]C(=O)C | |
| AKOS005215611 | 252.27 | C11 H16 N4 O3 | NNMBDKLZBBENLV-UHFFFAOYSA-N | InChI=1S/C11H16N4O3/c1-6-11(2,3)12-10(17)14(4)7-8-9(16)18-13-15(8)5/h1H,7H2,2-5H3,(H-,12,13,16,17) | CC(C)(C#C)NC(=O)N(C)Cc1c(on[n+]1C)[O-] | |
| AKOS005215716 | 268.269 | C11 H16 N4 O4 | UBBYSGVDQOCHQW-UHFFFAOYSA-N | InChI=1S/C11H16N4O4/c1-9(17)12-11-10(8-16)15(13-19-11)3-2-14-4-6-18-7-5-14/h8H,2-7H2,1H3 | CC(=O)[N-]c1c([n+](no1)CCN2CCOCC2)C=O | |
| AKOS005215030 | 288.731 | C11 H17 Cl N4 O3 | GHYWBSFHXRFZBB-UHFFFAOYSA-N | InChI=1S/C11H17ClN4O3/c1-9(17)13-11-10(8-12)16(14-19-11)3-2-15-4-6-18-7-5-15/h2-8H2,1H3 | CC(=O)[N-]c1c([n+](no1)CCN2CCOCC2)CCl | |
| AKOS005215736 | 223.272 | C11 H17 N3 O2 | HLQMJKSGIDEKPV-UHFFFAOYSA-N | InChI=1S/C11H17N3O2/c1-9(15)12-11-8-14(13-16-11)10-6-4-2-3-5-7-10/h8,10H,2-7H2,1H3 | CC(=O)[N-]c1c[n+](no1)C2CCCCCC2 | |
| AKOS005252639 | 255.337 | C11 H17 N3 O2 S | ALSQDSBJPSXGAK-UHFFFAOYSA-N | InChI=1S/C11H17N3O2S/c1-14-7-11(16-13-14)12-10(15)8-17-9-5-3-2-4-6-9/h7,9H,2-6,8H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSC2CCCCC2 | |
| AKOS005214925 | 239.271 | C11 H17 N3 O3 | GCLZPEDHZOYSSA-UHFFFAOYSA-N | InChI=1S/C11H17N3O3/c1-8(16)12-11-10(7-15)14(13-17-11)9-5-3-2-4-6-9/h9,15H,2-7H2,1H3 | CC(=O)[N-]c1c([n+](no1)C2CCCCC2)CO | |
| AKOS005219459 | 287.335 | C11 H17 N3 O4 S | SDGFIIZXNKTRCF-UHFFFAOYSA-N | InChI=1S/C11H17N3O4S/c1-4-17-11(16)7-19-6-9(15)12-10-5-14(8(2)3)13-18-10/h5,8H,4,6-7H2,1-3H3 | CCOC(=O)CSCC(=O)[N-]c1c[n+](no1)C(C)C | |
| AKOS005219508 | 271.27 | C11 H17 N3 O5 | DMFRFCNLRMNHCL-UHFFFAOYSA-N | InChI=1S/C11H17N3O5/c1-7(2)14-8(6-15)9(18-13-14)12-19-10(16)17-11(3,4)5/h6-7H,1-5H3 | CC(C)[n+]1c(c(on1)[N-]OC(=O)OC(C)(C)C)C=O | |
| AKOS005215063 | 238.286 | C11 H18 N4 O2 | PEECDRVWJKYRRG-UHFFFAOYSA-N | InChI=1S/C11H18N4O2/c1-8(16)13-11-10(7-12)15(14-17-11)9-5-3-2-4-6-9/h9H,2-7,12H2,1H3 | CC(=O)[N-]c1c([n+](no1)C2CCCCC2)CN | |
| AKOS005219498 | 238.286 | C11 H18 N4 O2 | LVTVAUXRVQHPSY-UHFFFAOYSA-N | InChI=1S/C11H18N4O2/c1-9(2)15-8-11(17-13-15)12-10(16)7-14-5-3-4-6-14/h8-9H,3-7H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CN2CCCC2 | |
| AKOS005215013 | 254.286 | C11 H18 N4 O3 | UWPLWHXGOCDKPY-UHFFFAOYSA-N | InChI=1S/C11H18N4O3/c1-8(16)10-11(12-9(2)17)18-13-15(10)14-6-4-3-5-7-14/h8,16H,3-7H2,1-2H3 | CC(c1c(on[n+]1N2CCCCC2)[N-]C(=O)C)O | |
| AKOS005219497 | 254.286 | C11 H18 N4 O3 | IYDRAVJRAWPVBC-UHFFFAOYSA-N | InChI=1S/C11H18N4O3/c1-9(2)15-8-11(18-13-15)12-10(16)7-14-3-5-17-6-4-14/h8-9H,3-7H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CN2CCOCC2 | |
| AKOS005215578 | 270.285 | C11 H18 N4 O4 | NQNHIDGOOXJMHR-UHFFFAOYSA-N | InChI=1S/C11H18N4O4/c1-11(2,3)18-10(16)12-9-8-15(13-19-9)14-4-6-17-7-5-14/h8H,4-7H2,1-3H3 | CC(C)(C)OC(=O)[N-]c1c[n+](no1)N2CCOCC2 | |
| AKOS005215637 | 270.285 | C11 H18 N4 O4 | OWVBXBCPFKTDHJ-UHFFFAOYSA-N | InChI=1S/C11H18N4O4/c1-9(17)12-11-10(8-16)15(13-19-11)3-2-14-4-6-18-7-5-14/h16H,2-8H2,1H3 | CC(=O)[N-]c1c([n+](no1)CCN2CCOCC2)CO | |
| AKOS005219478 | 286.284 | C11 H18 N4 O5 | LJQSBRQRNFTDDT-UHFFFAOYSA-N | InChI=1S/C11H18N4O5/c1-11(2,3)18-10(16)20-12-9-8-15(13-19-9)14-4-6-17-7-5-14/h8H,4-7H2,1-3H3 | CC(C)(C)OC(=O)O[N-]c1c[n+](no1)N2CCOCC2 | |
| AKOS005214177 | 225.287 | C11 H19 N3 O2 | GPKFGDOQNRUETD-UHFFFAOYSA-N | InChI=1S/C11H19N3O2/c1-8(2)14-10(11(15)16-13-14)7-12-9-5-3-4-6-9/h8-9,12H,3-7H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNC2CCCC2 | |
| AKOS005214241 | 225.287 | C11 H19 N3 O2 | OTROAPKTWOSQCB-UHFFFAOYSA-N | InChI=1S/C11H19N3O2/c1-14-10(11(15)16-13-14)8-12-9-6-4-2-3-5-7-9/h9,12H,2-8H2,1H3 | C[n+]1c(c(on1)[O-])CNC2CCCCCC2 | |
| AKOS005214231 | 241.287 | C11 H19 N3 O3 | LQFLWPQYDVULQW-UHFFFAOYSA-N | InChI=1S/C11H19N3O3/c1-8(2)14-10(11(15)17-13-14)7-12-6-9-4-3-5-16-9/h8-9,12H,3-7H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCC2CCCO2 | |
| AKOS005250248 | 241.287 | C11 H19 N3 O3 | KVRHNEIMZUPYBI-UHFFFAOYSA-N | InChI=1S/C11H19N3O3/c1-11(2,3)6-9(15)13(4)7-8-10(16)17-12-14(8)5/h6-7H2,1-5H3 | CC(C)(C)CC(=O)N(C)Cc1c(on[n+]1C)[O-] | |
| AKOS005214932 | 253.301 | C11 H19 N5 O2 | NJDGZTHGQIVEOM-UHFFFAOYSA-N | InChI=1S/C11H19N5O2/c1-9(17)13-11-10(8-12-2)16(14-18-11)15-6-4-3-5-7-15/h12H,3-8H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)N2CCCCC2)CNC | |
| AKOS005214892 | 269.3 | C11 H19 N5 O3 | FPCALMRTCUDQKF-UHFFFAOYSA-N | InChI=1S/C11H19N5O3/c1-9(17)13-11-10(8-12)16(14-19-11)3-2-15-4-6-18-7-5-15/h2-8,12H2,1H3 | CC(=O)[N-]c1c([n+](no1)CCN2CCOCC2)CN | |
| AKOS005214304 | 240.302 | C11 H20 N4 O2 | VTFIVHNMSKMSKR-UHFFFAOYSA-N | InChI=1S/C11H20N4O2/c1-9(2)15-10(11(16)17-13-15)8-12-14-6-4-3-5-7-14/h9,12H,3-8H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNN2CCCCC2 | |
| AKOS005219496 | 240.302 | C11 H20 N4 O2 | CEWKTMSSEXYQQO-UHFFFAOYSA-N | InChI=1S/C11H20N4O2/c1-5-14(6-2)7-10(16)12-11-8-15(9(3)4)13-17-11/h8-9H,5-7H2,1-4H3 | CCN(CC)CC(=O)[N-]c1c[n+](no1)C(C)C | |
| AKOS005215701 | 244.27 | C11 H21 N2 O2 P | LNELCCKXZQRZOQ-UHFFFAOYSA-N | InChI=1S/C11H21N2O2P/c1-4-6-8-16(9-7-5-2)10-11(14)15-12-13(10)3/h4-9H2,1-3H3 | CCCCP(CCCC)c1c(on[n+]1C)[O-] | |
| AKOS005214255 | 227.303 | C11 H21 N3 O2 | YFIZPYLFQOJSKG-UHFFFAOYSA-N | InChI=1S/C11H21N3O2/c1-6-11(4,5)12-7-9-10(15)16-13-14(9)8(2)3/h8,12H,6-7H2,1-5H3 | CCC(C)(C)NCc1c(on[n+]1C(C)C)[O-] | |
| AKOS005214207 | 243.303 | C11 H21 N3 O3 | JDTKIUWFTYSGSM-UHFFFAOYSA-N | InChI=1S/C11H21N3O3/c1-4-16-7-5-6-12-8-10-11(15)17-13-14(10)9(2)3/h9,12H,4-8H2,1-3H3 | CCOCCCNCc1c(on[n+]1C(C)C)[O-] | |
| AKOS005214315 | 242.318 | C11 H22 N4 O2 | JEVMZHSPLUVCLS-UHFFFAOYSA-N | InChI=1S/C11H22N4O2/c1-9(2)15-10(11(16)17-13-15)8-12-6-5-7-14(3)4/h9,12H,5-8H2,1-4H3 | CC(C)[n+]1c(c(on1)[O-])CNCCCN(C)C | |
| AKOS005250550 | 359.157 | C11 H4 F7 N3 O3 | SUBDSPVFPSVUBX-UHFFFAOYSA-N | InChI=1S/C11H4F7N3O3/c1-21-8(10(23)24-20-21)9(22)19-7-5(14)3(12)2(11(16,17)18)4(13)6(7)15/h1H3,(H-,19,20,22,23) | C[n+]1c(c(on1)[O-])C(=O)Nc2c(c(c(c(c2F)F)C(F)(F)F)F)F | |
| AKOS005250511 | 321.64 | C11 H7 Cl F3 N3 O3 | XTZOWBVGKOCUDC-UHFFFAOYSA-N | InChI=1S/C11H7ClF3N3O3/c1-18-8(10(20)21-17-18)9(19)16-7-3-2-5(12)4-6(7)11(13,14)15/h2-4H,1H3,(H-,16,17,19,20) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2C(F)(F)F)Cl | |
| AKOS005250512 | 321.64 | C11 H7 Cl F3 N3 O3 | DUJYMMGOFARUSO-UHFFFAOYSA-N | InChI=1S/C11H7ClF3N3O3/c1-18-8(10(20)21-17-18)9(19)16-7-4-5(11(13,14)15)2-3-6(7)12/h2-4H,1H3,(H-,16,17,19,20) | C[n+]1c(c(on1)[O-])C(=O)Nc2cc(ccc2Cl)C(F)(F)F | |
| AKOS005251116 | 337.25 | C11 H7 F4 N3 O3 S | JKBMNAZAZVSVEA-UHFFFAOYSA-N | InChI=1S/C11H7F4N3O3S/c1-18-10(11(20)21-17-18)22-3-6(19)16-9-7(14)4(12)2-5(13)8(9)15/h2H,3H2,1H3,(H-,16,17,19,20) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2c(c(cc(c2F)F)F)F | |
| AKOS005252634 | 277.322 | C11 H7 N3 O2 S2 | NYECWFDLLBLWJO-UHFFFAOYSA-N | InChI=1S/C11H7N3O2S2/c15-10-9(8-6-18-11(17)12-8)14(13-16-10)7-4-2-1-3-5-7/h1-6H,(H-,12,13,15,17) | c1ccc(cc1)[n+]2c(c(on2)[O-])c3csc(n3)S | |
| AKOS005250538 | 297.651 | C11 H8 Cl N3 O5 | ISUGDVIVSZUGGS-UHFFFAOYSA-N | InChI=1S/C11H8ClN3O5/c1-15-8(11(19)20-14-15)9(16)13-5-2-3-7(12)6(4-5)10(17)18/h2-4H,1H3,(H2-,13,14,16,17,18,19) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(c(c2)C(=O)O)Cl | |
| AKOS005250539 | 297.651 | C11 H8 Cl N3 O5 | FVERNOCBKYKYPJ-UHFFFAOYSA-N | InChI=1S/C11H8ClN3O5/c1-15-8(11(19)20-14-15)9(16)13-7-4-5(10(17)18)2-3-6(7)12/h2-4H,1H3,(H2-,13,14,16,17,18,19) | C[n+]1c(c(on1)[O-])C(=O)Nc2cc(ccc2Cl)C(=O)O | |
| AKOS005215671 | 320.559 | C11 H8 Cl3 N3 O2 | GOAJZPSRSWEGFL-UHFFFAOYSA-N | InChI=1S/C11H8Cl3N3O2/c12-4-10(18)15-11-6-17(16-19-11)5-7-1-2-8(13)3-9(7)14/h1-3,6H,4-5H2 | c1cc(c(cc1Cl)Cl)C[n+]2cc(on2)[N-]C(=O)CCl | |
| AKOS000489705 | 271.195 | C11 H8 F3 N3 O2 | NLFRPZDXLZBAIP-UHFFFAOYSA-N | InChI=1S/C11H8F3N3O2/c1-17-8(7-5-3-2-4-6-7)9(19-16-17)15-10(18)11(12,13)14/h2-6H,1H3 | C[n+]1c(c(on1)[N-]C(=O)C(F)(F)F)c2ccccc2 | MFCD02655586 |
| AKOS005250506 | 287.195 | C11 H8 F3 N3 O3 | JHLSEZLETWXYNU-UHFFFAOYSA-N | InChI=1S/C11H8F3N3O3/c1-17-8(10(19)20-16-17)9(18)15-7-5-3-2-4-6(7)11(12,13)14/h2-5H,1H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2C(F)(F)F | |
| AKOS005250507 | 287.195 | C11 H8 F3 N3 O3 | CJVDKZRWDQHECL-UHFFFAOYSA-N | InChI=1S/C11H8F3N3O3/c1-17-8(10(19)20-16-17)9(18)15-7-4-2-3-6(5-7)11(12,13)14/h2-5H,1H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])C(=O)Nc2cccc(c2)C(F)(F)F | |
| AKOS005250578 | 303.194 | C11 H8 F3 N3 O4 | TUNZYXNQRCYYKT-UHFFFAOYSA-N | InChI=1S/C11H8F3N3O4/c1-17-8(10(19)21-16-17)9(18)15-6-2-4-7(5-3-6)20-11(12,13)14/h2-5H,1H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)OC(F)(F)F | |
| AKOS005250585 | 303.194 | C11 H8 F3 N3 O4 | CKQAWPXXCWNWBB-UHFFFAOYSA-N | InChI=1S/C11H8F3N3O4/c1-17-8(10(19)21-16-17)9(18)15-6-4-2-3-5-7(6)20-11(12,13)14/h2-5H,1H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2OC(F)(F)F | |
| AKOS005215633 | 232.258 | C11 H8 N2 O2 S | IZHQQSBUVUUQFA-UHFFFAOYSA-N | InChI=1S/C11H8N2O2S/c1-2-8-16-10-11(14)15-12-13(10)9-6-4-3-5-7-9/h1,3-7H,8H2 | C#CCSc1c(on[n+]1c2ccccc2)[O-] | MFCD09881665 |
| AKOS005252633 | 296.733 | C11 H8 N4 O2 S . Cl H | HVCFXRDUZYWDEV-UHFFFAOYSA-N | InChI=1S/C11H8N4O2S.ClH/c12-11-13-8(6-18-11)9-10(16)17-14-15(9)7-4-2-1-3-5-7;/h1-6H,(H2-,12,13,14,16);1H | c1ccc(cc1)[n+]2c(c(on2)[O-])c3csc(n3)N.Cl | |
| AKOS005251325 | 362.175 | C11 H9 Br F N3 O3 S | ZPAZRVQPDWXYKV-UHFFFAOYSA-N | InChI=1S/C11H9BrFN3O3S/c1-16-10(11(18)19-15-16)20-5-9(17)14-8-3-2-6(12)4-7(8)13/h2-4H,5H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2F)Br | |
| AKOS005215681 | 269.659 | C11 H9 Cl F N3 O2 | OXRXKXXTANTUTH-UHFFFAOYSA-N | InChI=1S/C11H9ClFN3O2/c12-5-10(17)14-11-7-16(15-18-11)6-8-1-3-9(13)4-2-8/h1-4,7H,5-6H2 | c1cc(ccc1C[n+]2cc(on2)[N-]C(=O)CCl)F | |
| AKOS005251307 | 317.724 | C11 H9 Cl F N3 O3 S | RZYZRBLMPFISKJ-UHFFFAOYSA-N | InChI=1S/C11H9ClFN3O3S/c1-16-10(11(18)19-15-16)20-5-9(17)14-6-2-3-8(13)7(12)4-6/h2-4H,5H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(c(c2)Cl)F | |
| AKOS005219549 | 284.719 | C11 H9 Cl N2 O3 S | ANWNRRMIBXLFQA-UHFFFAOYSA-N | InChI=1S/C11H9ClN2O3S/c1-14-10(11(16)17-13-14)9(15)6-18-8-4-2-7(12)3-5-8/h2-5H,6H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2ccc(cc2)Cl | |
| AKOS005215541 | 286.114 | C11 H9 Cl2 N3 O2 | CXZYNDKBLNZTBM-UHFFFAOYSA-N | InChI=1S/C11H9Cl2N3O2/c1-7(17)14-11-6-16(15-18-11)5-8-2-3-9(12)4-10(8)13/h2-4,6H,5H2,1H3 | CC(=O)[N-]c1c[n+](no1)Cc2ccc(cc2Cl)Cl | |
| AKOS005215694 | 286.114 | C11 H9 Cl2 N3 O2 | SDZVFOIJPCTGNL-UHFFFAOYSA-N | InChI=1S/C11H9Cl2N3O2/c12-5-10(17)14-11-7-16(15-18-11)6-8-3-1-2-4-9(8)13/h1-4,7H,5-6H2 | c1ccc(c(c1)C[n+]2cc(on2)[N-]C(=O)CCl)Cl | |
| AKOS005251289 | 334.178 | C11 H9 Cl2 N3 O3 S | CIASDLKZHFVZGU-UHFFFAOYSA-N | InChI=1S/C11H9Cl2N3O3S/c1-16-10(11(18)19-15-16)20-5-9(17)14-8-4-6(12)2-3-7(8)13/h2-4H,5H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2cc(ccc2Cl)Cl | |
| AKOS005251290 | 334.178 | C11 H9 Cl2 N3 O3 S | DPGALQNOPALARC-UHFFFAOYSA-N | InChI=1S/C11H9Cl2N3O3S/c1-16-10(11(18)19-15-16)20-5-9(17)14-6-2-3-7(12)8(13)4-6/h2-4H,5H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(c(c2)Cl)Cl | |
| AKOS005251291 | 334.178 | C11 H9 Cl2 N3 O3 S | NVURYWQOQZYXMG-UHFFFAOYSA-N | InChI=1S/C11H9Cl2N3O3S/c1-16-10(11(18)19-15-16)20-5-9(17)14-8-3-6(12)2-7(13)4-8/h2-4H,5H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2cc(cc(c2)Cl)Cl | |
| AKOS005251334 | 334.178 | C11 H9 Cl2 N3 O3 S | XFGMVVMYSJBGHC-UHFFFAOYSA-N | InChI=1S/C11H9Cl2N3O3S/c1-16-10(11(18)19-15-16)20-5-8(17)14-7-4-2-3-6(12)9(7)13/h2-4H,5H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2cccc(c2Cl)Cl | |
| AKOS005251335 | 334.178 | C11 H9 Cl2 N3 O3 S | LIAIGYXRVDWCEQ-UHFFFAOYSA-N | InChI=1S/C11H9Cl2N3O3S/c1-16-10(11(18)19-15-16)20-5-9(17)14-8-3-2-6(12)4-7(8)13/h2-4H,5H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2Cl)Cl | |
| AKOS005251130 | 301.269 | C11 H9 F2 N3 O3 S | BLLWBIXIDHYCRN-UHFFFAOYSA-N | InChI=1S/C11H9F2N3O3S/c1-16-10(11(18)19-15-16)20-5-9(17)14-6-2-3-7(12)8(13)4-6/h2-4H,5H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(c(c2)F)F | |
| AKOS005215518 | 231.207 | C11 H9 N3 O3 | QCZIKYAZOTYUQH-UHFFFAOYSA-N | InChI=1S/C11H9N3O3/c1-14-9(7-15)11(17-13-14)12-10(16)8-5-3-2-4-6-8/h2-7H,1H3 | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)C=O | |
| AKOS005251274 | 263.272 | C11 H9 N3 O3 S | XFZBFBQBUNMXRS-UHFFFAOYSA-N | InChI=1S/C11H9N3O3S/c1-16-9-4-2-8(3-5-9)14-10(18-7-6-12)11(15)17-13-14/h2-5H,7H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC#N | |
| AKOS005250540 | 263.206 | C11 H9 N3 O5 | SZNJFJBZXLMZIU-UHFFFAOYSA-N | InChI=1S/C11H9N3O5/c1-14-8(11(18)19-13-14)9(15)12-7-4-2-6(3-5-7)10(16)17/h2-5H,1H3,(H2-,12,13,15,16,17,18) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)C(=O)O | |
| AKOS005250541 | 263.206 | C11 H9 N3 O5 | XVLJVZRJXWLMHH-UHFFFAOYSA-N | InChI=1S/C11H9N3O5/c1-14-8(11(18)19-13-14)9(15)12-7-4-2-3-6(5-7)10(16)17/h2-5H,1H3,(H2-,12,13,15,16,17,18) | C[n+]1c(c(on1)[O-])C(=O)Nc2cccc(c2)C(=O)O | |
| AKOS005250577 | 263.206 | C11 H9 N3 O5 | HMFUTARHKKVAHS-UHFFFAOYSA-N | InChI=1S/C11H9N3O5/c1-14-9(11(16)19-13-14)10(15)12-6-2-3-7-8(4-6)18-5-17-7/h2-4H,5H2,1H3,(H-,12,13,15,16) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc3c(c2)OCO3 | |
| AKOS005250567 | 279.206 | C11 H9 N3 O6 | JCQTUDMLEMNBPD-UHFFFAOYSA-N | InChI=1S/C11H9N3O6/c1-14-8(11(19)20-13-14)9(16)12-5-2-3-7(15)6(4-5)10(17)18/h2-4,13H,1H3,(H2,16,17,18,19) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(c(c2)C(=O)O)O | |
| AKOS005251231 | 309.278 | C11 H9 N4 O5 S | YPZPEZKUYUIRDH-UHFFFAOYSA-M | InChI=1S/C11H10N4O5S/c1-14-10(11(17)20-13-14)21-6-9(16)12-7-2-4-8(5-3-7)15(18)19/h2,4-5,17H,6H2,1H3,(H,12,16)/p-1 | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(c[c-]2)[N+](=O)[O-] | |
| AKOS005215692 | 279.679 | C12 H10 Cl N3 O3 | SKSJDBIMSHYAOD-UHFFFAOYSA-N | InChI=1S/C12H10ClN3O3/c1-8(18)14-12-11(7-17)16(15-19-12)6-9-4-2-3-5-10(9)13/h2-5,7H,6H2,1H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccccc2Cl)C=O | |
| AKOS005251226 | 343.743 | C12 H10 Cl N3 O5 S | KCVVVJBJQHGTKR-UHFFFAOYSA-N | InChI=1S/C12H10ClN3O5S/c1-16-10(12(20)21-15-16)22-5-9(17)14-6-2-3-8(13)7(4-6)11(18)19/h2-4H,5H2,1H3,(H2-,14,15,17,18,19,20) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(c(c2)C(=O)O)Cl | |
| AKOS005251227 | 343.743 | C12 H10 Cl N3 O5 S | YXRPWNXFZFZDII-UHFFFAOYSA-N | InChI=1S/C12H10ClN3O5S/c1-16-10(12(20)21-15-16)22-5-9(17)14-8-4-6(11(18)19)2-3-7(8)13/h2-4H,5H2,1H3,(H2-,14,15,17,18,19,20) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2cc(ccc2Cl)C(=O)O | |
| AKOS005214988 | 334.586 | C12 H10 Cl3 N3 O2 | BLIRIQFYVIBXRH-UHFFFAOYSA-N | InChI=1S/C12H10Cl3N3O2/c1-7(19)16-12-11(5-13)18(17-20-12)6-8-2-3-9(14)4-10(8)15/h2-4H,5-6H2,1H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2Cl)Cl)CCl | |
| AKOS005215679 | 263.224 | C12 H10 F N3 O3 | MZWGAPDBGPCRFB-UHFFFAOYSA-N | InChI=1S/C12H10FN3O3/c1-8(18)14-12-11(7-17)16(15-19-12)6-9-2-4-10(13)5-3-9/h2-5,7H,6H2,1H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2)F)C=O | |
| AKOS005250263 | 301.221 | C12 H10 F3 N3 O3 | DXRCHLINLRWXRJ-UHFFFAOYSA-N | InChI=1S/C12H10F3N3O3/c1-17(11(20)12(13,14)15)7-9-10(19)21-16-18(9)8-5-3-2-4-6-8/h2-6H,7H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)C(F)(F)F | |
| AKOS005251299 | 333.286 | C12 H10 F3 N3 O3 S | HAZKFAZZFNYTTJ-UHFFFAOYSA-N | InChI=1S/C12H10F3N3O3S/c1-18-10(11(20)21-17-18)22-6-9(19)16-8-5-3-2-4-7(8)12(13,14)15/h2-5H,6H2,1H3,(H-,16,17,19,20) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccccc2C(F)(F)F | |
| AKOS005251300 | 333.286 | C12 H10 F3 N3 O3 S | XBRRYQRNMCGCIW-UHFFFAOYSA-N | InChI=1S/C12H10F3N3O3S/c1-18-10(11(20)21-17-18)22-6-9(19)16-8-4-2-3-7(5-8)12(13,14)15/h2-5H,6H2,1H3,(H-,16,17,19,20) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2cccc(c2)C(F)(F)F | |
| AKOS005251126 | 349.286 | C12 H10 F3 N3 O4 S | ACGFOOPCODQEPJ-UHFFFAOYSA-N | InChI=1S/C12H10F3N3O4S/c1-18-10(11(20)22-17-18)23-6-9(19)16-7-2-4-8(5-3-7)21-12(13,14)15/h2-5H,6H2,1H3,(H-,16,17,19,20) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)OC(F)(F)F | |
| AKOS005251127 | 349.286 | C12 H10 F3 N3 O4 S | HZWXBKDRXYMLSY-UHFFFAOYSA-N | InChI=1S/C12H10F3N3O4S/c1-18-10(11(20)22-17-18)23-6-9(19)16-7-4-2-3-5-8(7)21-12(13,14)15/h2-5H,6H2,1H3,(H-,16,17,19,20) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccccc2OC(F)(F)F | |
| AKOS005215699 | 230.219 | C12 H10 N2 O3 | INNOJSJFEYNWFI-UHFFFAOYSA-N | InChI=1S/C12H10N2O3/c15-11(8-6-7-8)10-12(16)17-13-14(10)9-4-2-1-3-5-9/h1-5,8H,6-7H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)C3CC3 | |
| AKOS005215533 | 262.218 | C12 H10 N2 O5 | SOBAWFTZHGIDIC-UHFFFAOYSA-N | InChI=1S/C12H10N2O5/c1-2-18-12(17)10(15)9-11(16)19-13-14(9)8-6-4-3-5-7-8/h3-7H,2H2,1H3 | CCOC(=O)C(=O)c1c(on[n+]1c2ccccc2)[O-] | MFCD09881669 |
| AKOS005250587 | 258.233 | C12 H10 N4 O3 | CWACSEHIRXQVDU-UHFFFAOYSA-N | InChI=1S/C12H10N4O3/c1-16-10(12(18)19-15-16)11(17)14-8-2-3-9-7(6-8)4-5-13-9/h2-6,15H,1H3,(H,17,18) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc3c(c2)cc[nH]3 | |
| AKOS005250681 | 290.298 | C12 H10 N4 O3 S | YNESDKZNDDGYGZ-UHFFFAOYSA-N | InChI=1S/C12H10N4O3S/c1-16-10(11(18)19-15-16)9(17)6-20-12-13-7-4-2-3-5-8(7)14-12/h2-5H,6H2,1H3,(H-,13,14,15,17,18) | C[n+]1c(c(on1)[O-])C(=O)CSc2[nH]c3ccccc3n2 | |
| AKOS005250740 | 290.298 | C12 H10 N4 O3 S | UEUVBFPEZRRVTQ-UHFFFAOYSA-N | InChI=1S/C12H10N4O3S/c1-7-3-4-8(5-13)11(14-7)20-6-9(17)10-12(18)19-15-16(10)2/h3-4H,6H2,1-2H3 | Cc1ccc(c(n1)SCC(=O)c2c(on[n+]2C)[O-])C#N | |
| AKOS005252591 | 290.298 | C12 H10 N4 O3 S | GQANLDJCDCYKBL-UHFFFAOYSA-N | InChI=1S/C12H10N4O3S/c1-16-6-11(19-15-16)14-10(17)7-20-12-13-8-4-2-3-5-9(8)18-12/h2-6H,7H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3o2 | |
| AKOS005253839 | 290.298 | C12 H10 N4 O3 S | LGZGGLBXBZSAJJ-UHFFFAOYSA-N | InChI=1S/C12H10N4O3S/c1-5-3-4-6-7(13)10(20-11(6)14-5)9(17)8-12(18)19-15-16(8)2/h3-4H,1-2H3,(H2-,13,15,17,18) | Cc1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3C)[O-])N | |
| AKOS005252623 | 326.759 | C12 H10 N4 O3 S . Cl H | UQCAZLUAQHMRCI-UHFFFAOYSA-N | InChI=1S/C12H10N4O3S.ClH/c1-18-8-4-2-7(3-5-8)16-10(11(17)19-15-16)9-6-20-12(13)14-9;/h2-6H,1H3,(H2-,13,14,15,17);1H | COc1ccc(cc1)[n+]2c(c(on2)[O-])c3csc(n3)N.Cl | |
| AKOS005250687 | 318.311 | C12 H10 N6 O3 S | DESIITMYUKANLN-UHFFFAOYSA-N | InChI=1S/C12H10N6O3S/c1-17-10(11(20)21-16-17)9(19)7-22-12-13-14-15-18(12)8-5-3-2-4-6-8/h2-6H,7H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2nnnn2c3ccccc3 | |
| AKOS005251397 | 376.201 | C12 H11 Br F N3 O3 S | KUWJDMMCCIAIFF-UHFFFAOYSA-N | InChI=1S/C12H11BrFN3O3S/c1-6(21-11-12(19)20-16-17(11)2)10(18)15-9-4-3-7(13)5-8(9)14/h3-6H,1-2H3,(H-,15,16,18,19) | CC(C(=O)Nc1ccc(cc1F)Br)Sc2c(on[n+]2C)[O-] | |
| AKOS005252287 | 376.201 | C12 H11 Br F N3 O3 S | PZWLJFDRGNNJGK-UHFFFAOYSA-N | InChI=1S/C12H11BrFN3O3S/c1-17-11(12(19)20-16-17)21-5-4-10(18)15-9-3-2-7(13)6-8(9)14/h2-3,6H,4-5H2,1H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2F)Br | |
| AKOS005214989 | 283.686 | C12 H11 Cl F N3 O2 | NYZDEHGPMKHIIX-UHFFFAOYSA-N | InChI=1S/C12H11ClFN3O2/c1-8(18)15-12-11(6-13)17(16-19-12)7-9-2-4-10(14)5-3-9/h2-5H,6-7H2,1H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2)F)CCl | |
| AKOS005251401 | 331.75 | C12 H11 Cl F N3 O3 S | AEPYOEQJJBYQTI-UHFFFAOYSA-N | InChI=1S/C12H11ClFN3O3S/c1-6(21-11-12(19)20-16-17(11)2)10(18)15-7-3-4-9(14)8(13)5-7/h3-6H,1-2H3,(H-,15,16,18,19) | CC(C(=O)Nc1ccc(c(c1)Cl)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005252291 | 331.75 | C12 H11 Cl F N3 O3 S | RPBKXIFHTLFGQY-UHFFFAOYSA-N | InChI=1S/C12H11ClFN3O3S/c1-17-11(12(19)20-16-17)21-5-4-10(18)15-7-2-3-9(14)8(13)6-7/h2-3,6H,4-5H2,1H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(c(c2)Cl)F | |
| AKOS005215003 | 300.141 | C12 H11 Cl2 N3 O2 | JHZNAFBKILCAPB-UHFFFAOYSA-N | InChI=1S/C12H11Cl2N3O2/c1-8(18)15-12-11(6-13)17(16-19-12)7-9-4-2-3-5-10(9)14/h2-5H,6-7H2,1H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccccc2Cl)CCl | |
| AKOS005214938 | 316.14 | C12 H11 Cl2 N3 O3 | SEKSFHBZAKRFOQ-UHFFFAOYSA-N | InChI=1S/C12H11Cl2N3O3/c1-7(19)15-12-11(6-18)17(16-20-12)5-8-2-3-9(13)4-10(8)14/h2-4,18H,5-6H2,1H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2Cl)Cl)CO | |
| AKOS005250374 | 316.14 | C12 H11 Cl2 N3 O3 | VPSPTMKGLUXBCN-UHFFFAOYSA-N | InChI=1S/C12H11Cl2N3O3/c1-16(6-10-12(19)20-15-17(10)2)11(18)8-4-3-7(13)5-9(8)14/h3-5H,6H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)c2ccc(cc2Cl)Cl | |
| AKOS005251405 | 348.205 | C12 H11 Cl2 N3 O3 S | MXTWEMLDIIXSFE-UHFFFAOYSA-N | InChI=1S/C12H11Cl2N3O3S/c1-6(21-11-12(19)20-16-17(11)2)10(18)15-8-5-3-4-7(13)9(8)14/h3-6H,1-2H3,(H-,15,16,18,19) | CC(C(=O)Nc1cccc(c1Cl)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005251406 | 348.205 | C12 H11 Cl2 N3 O3 S | VXWHKJDBSJHEAS-UHFFFAOYSA-N | InChI=1S/C12H11Cl2N3O3S/c1-6(21-11-12(19)20-16-17(11)2)10(18)15-9-4-3-7(13)5-8(9)14/h3-6H,1-2H3,(H-,15,16,18,19) | CC(C(=O)Nc1ccc(cc1Cl)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005251407 | 348.205 | C12 H11 Cl2 N3 O3 S | TWYDYEOLRMOOGY-UHFFFAOYSA-N | InChI=1S/C12H11Cl2N3O3S/c1-6(21-11-12(19)20-16-17(11)2)10(18)15-9-5-7(13)3-4-8(9)14/h3-6H,1-2H3,(H-,15,16,18,19) | CC(C(=O)Nc1cc(ccc1Cl)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005251408 | 348.205 | C12 H11 Cl2 N3 O3 S | SLRZRPCHIFCMAG-UHFFFAOYSA-N | InChI=1S/C12H11Cl2N3O3S/c1-6(21-11-12(19)20-16-17(11)2)10(18)15-7-3-4-8(13)9(14)5-7/h3-6H,1-2H3,(H-,15,16,18,19) | CC(C(=O)Nc1ccc(c(c1)Cl)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005251409 | 348.205 | C12 H11 Cl2 N3 O3 S | XAMXLVITUWRWHW-UHFFFAOYSA-N | InChI=1S/C12H11Cl2N3O3S/c1-6(21-11-12(19)20-16-17(11)2)10(18)15-9-4-7(13)3-8(14)5-9/h3-6H,1-2H3,(H-,15,16,18,19) | CC(C(=O)Nc1cc(cc(c1)Cl)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005252305 | 348.205 | C12 H11 Cl2 N3 O3 S | AZMDAABYWIVOPX-UHFFFAOYSA-N | InChI=1S/C12H11Cl2N3O3S/c1-17-11(12(19)20-16-17)21-6-5-9(18)15-8-4-2-3-7(13)10(8)14/h2-4H,5-6H2,1H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cccc(c2Cl)Cl | |
| AKOS005252306 | 348.205 | C12 H11 Cl2 N3 O3 S | CZLVAIKOGMBDSI-UHFFFAOYSA-N | InChI=1S/C12H11Cl2N3O3S/c1-17-11(12(19)20-16-17)21-5-4-10(18)15-9-3-2-7(13)6-8(9)14/h2-3,6H,4-5H2,1H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2Cl)Cl | |
| AKOS005252307 | 348.205 | C12 H11 Cl2 N3 O3 S | NFMYWFOVRMPJMR-UHFFFAOYSA-N | InChI=1S/C12H11Cl2N3O3S/c1-17-11(12(19)20-16-17)21-5-4-10(18)15-9-6-7(13)2-3-8(9)14/h2-3,6H,4-5H2,1H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cc(ccc2Cl)Cl | |
| AKOS005252315 | 348.205 | C12 H11 Cl2 N3 O3 S | NIJQTVLAEXTVGN-UHFFFAOYSA-N | InChI=1S/C12H11Cl2N3O3S/c1-17-11(12(19)20-16-17)21-5-4-10(18)15-7-2-3-8(13)9(14)6-7/h2-3,6H,4-5H2,1H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(c(c2)Cl)Cl | |
| AKOS005252316 | 348.205 | C12 H11 Cl2 N3 O3 S | YRQZHBOGBHGMIZ-UHFFFAOYSA-N | InChI=1S/C12H11Cl2N3O3S/c1-17-11(12(19)20-16-17)21-3-2-10(18)15-9-5-7(13)4-8(14)6-9/h4-6H,2-3H2,1H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cc(cc(c2)Cl)Cl | |
| AKOS005251506 | 315.296 | C12 H11 F2 N3 O3 S | WEIYXSGQFWCSHI-UHFFFAOYSA-N | InChI=1S/C12H11F2N3O3S/c1-6(21-11-12(19)20-16-17(11)2)10(18)15-7-3-4-8(13)9(14)5-7/h3-6H,1-2H3,(H-,15,16,18,19) | CC(C(=O)Nc1ccc(c(c1)F)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005252344 | 315.296 | C12 H11 F2 N3 O3 S | FVBXXLAIDSSXCO-UHFFFAOYSA-N | InChI=1S/C12H11F2N3O3S/c1-17-11(12(19)20-16-17)21-5-4-10(18)15-7-2-3-8(13)9(14)6-7/h2-3,6H,4-5H2,1H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(c(c2)F)F | |
| AKOS005215492 | 245.234 | C12 H11 N3 O3 | ZPDXWFXYORVBHT-UHFFFAOYSA-N | InChI=1S/C12H11N3O3/c1-2-15-10(8-16)12(18-14-15)13-11(17)9-6-4-3-5-7-9/h3-8H,2H2,1H3 | CC[n+]1c(c(on1)[N-]C(=O)c2ccccc2)C=O | |
| AKOS005215667 | 245.234 | C12 H11 N3 O3 | KWCIUPLOHVYZDI-UHFFFAOYSA-N | InChI=1S/C12H11N3O3/c1-9(17)13-12-11(8-16)15(14-18-12)7-10-5-3-2-4-6-10/h2-6,8H,7H2,1H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccccc2)C=O | |
| AKOS005250516 | 261.233 | C12 H11 N3 O4 | HMYBDABAJIGKKP-UHFFFAOYSA-N | InChI=1S/C12H11N3O4/c1-7(16)8-3-5-9(6-4-8)13-11(17)10-12(18)19-14-15(10)2/h3-6H,1-2H3,(H-,13,14,16,17,18) | CC(=O)c1ccc(cc1)NC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005219767 | 293.298 | C12 H11 N3 O4 S | RJXYDYCEFHNKDI-UHFFFAOYSA-N | InChI=1S/C12H11N3O4S/c16-11(17)8-6-13-10(20-8)9-12(18)19-14-15(9)7-4-2-1-3-5-7/h1-5,8,10,13H,6H2,(H-,14,16,17,18) | c1ccc(cc1)[n+]2c(c(on2)[O-])C3NCC(S3)C(=O)O | |
| AKOS005250531 | 277.233 | C12 H11 N3 O5 | LGFKPKQEQGMGHZ-UHFFFAOYSA-N | InChI=1S/C12H11N3O5/c1-15-9(12(18)20-14-15)10(16)13-8-6-4-3-5-7(8)11(17)19-2/h3-6H,1-2H3,(H-,13,14,16,17,18) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccccc2C(=O)OC | |
| AKOS005250559 | 277.233 | C12 H11 N3 O5 | TZQYYCUHIGUHLU-UHFFFAOYSA-N | InChI=1S/C12H11N3O5/c1-6-3-4-7(11(17)18)5-8(6)13-10(16)9-12(19)20-14-15(9)2/h3-5H,1-2H3,(H2-,13,14,16,17,18,19) | Cc1ccc(cc1NC(=O)c2c(on[n+]2C)[O-])C(=O)O | |
| AKOS005250576 | 277.233 | C12 H11 N3 O5 | OTWIHDGRXNFEAA-UHFFFAOYSA-N | InChI=1S/C12H11N3O5/c1-15-10(12(17)20-14-15)11(16)13-7-2-3-8-9(6-7)19-5-4-18-8/h2-3,6H,4-5H2,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc3c(c2)OCCO3 | |
| AKOS005251125 | 309.298 | C12 H11 N3 O5 S | CQVLVPRVDCYALE-UHFFFAOYSA-N | InChI=1S/C12H11N3O5S/c1-15-11(12(17)20-14-15)21-5-10(16)13-7-2-3-8-9(4-7)19-6-18-8/h2-4H,5-6H2,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc3c(c2)OCO3 | |
| AKOS005251228 | 309.298 | C12 H11 N3 O5 S | ABQQMWSPKVHPNM-UHFFFAOYSA-N | InChI=1S/C12H11N3O5S/c1-15-10(12(19)20-14-15)21-6-9(16)13-8-4-2-7(3-5-8)11(17)18/h2-5H,6H2,1H3,(H2-,13,14,16,17,18,19) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)C(=O)O | |
| AKOS005251238 | 309.298 | C12 H11 N3 O5 S | GTJSEFSHZBBTKS-UHFFFAOYSA-N | InChI=1S/C12H11N3O5S/c1-15-10(12(19)20-14-15)21-6-9(16)13-8-4-2-3-7(5-8)11(17)18/h2-5H,6H2,1H3,(H2-,13,14,16,17,18,19) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2cccc(c2)C(=O)O | |
| AKOS005250596 | 293.232 | C12 H11 N3 O6 | VZNJLIPWWHMOFF-UHFFFAOYSA-N | InChI=1S/C12H11N3O6/c1-15-9(12(19)21-14-15)10(16)13-7-4-3-6(11(17)18)5-8(7)20-2/h3-5H,1-2H3,(H2-,13,14,16,17,18,19) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2OC)C(=O)O | |
| AKOS005251121 | 325.297 | C12 H11 N3 O6 S | UDYBJEVRPWOEFK-UHFFFAOYSA-N | InChI=1S/C12H11N3O6S/c1-15-10(12(20)21-14-15)22-5-9(17)13-6-2-3-8(16)7(4-6)11(18)19/h2-4,14H,5H2,1H3,(H2,18,19,20) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(c(c2)C(=O)O)O | |
| AKOS005251424 | 323.305 | C12 H11 N4 O5 S | FWVUQOLCVLIFDP-UHFFFAOYSA-M | InChI=1S/C12H12N4O5S/c1-7(22-11-12(18)21-14-15(11)2)10(17)13-8-3-5-9(6-4-8)16(19)20/h3,5-7,18H,1-2H3,(H,13,17)/p-1 | CC(C(=O)Nc1ccc(c[c-]1)[N+](=O)[O-])Sc2c(on[n+]2C)[O-] | |
| AKOS005252338 | 323.305 | C12 H11 N4 O5 S | SWYGCRYFLREXAI-UHFFFAOYSA-M | InChI=1S/C12H12N4O5S/c1-15-11(12(18)21-14-15)22-7-6-10(17)13-8-2-4-9(5-3-8)16(19)20/h2,4-5,18H,6-7H2,1H3,(H,13,17)/p-1 | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(c[c-]2)[N+](=O)[O-] | |
| AKOS005252533 | 289.313 | C12 H11 N5 O2 S | JMNOIAXFUAFSGG-UHFFFAOYSA-N | InChI=1S/C12H11N5O2S/c1-8-3-4-9(5-13)12(14-8)20-7-10(18)15-11-6-17(2)16-19-11/h3-4,6H,7H2,1-2H3 | Cc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)C)C#N | |
| AKOS005252609 | 289.313 | C12 H11 N5 O2 S | JCEWWRRPHFJALV-UHFFFAOYSA-N | InChI=1S/C12H11N5O2S/c1-17-6-11(19-16-17)15-10(18)7-20-12-13-8-4-2-3-5-9(8)14-12/h2-6H,7H2,1H3,(H-,13,14,15,16,18) | C[n+]1cc(on1)[N-]C(=O)CSc2[nH]c3ccccc3n2 | |
| AKOS005252602 | 317.326 | C12 H11 N7 O2 S | HEAKGWYZKHICIX-UHFFFAOYSA-N | InChI=1S/C12H11N7O2S/c1-18-7-11(21-17-18)13-10(20)8-22-12-14-15-16-19(12)9-5-3-2-4-6-9/h2-7H,8H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2nnnn2c3ccccc3 | |
| AKOS005215529 | 342.212 | C12 H12 Br N3 O2 S | RPPFATPLTFJHSB-AATRIKPKSA-N | InChI=1S/C12H12BrN3O2S/c1-8(2)16-11(13)12(18-15-16)14-10(17)6-5-9-4-3-7-19-9/h3-8H,1-2H3/b6-5+ | CC(C)[n+]1c(c(on1)[N-]C(=O)/C=C/c2cccs2)Br | |
| AKOS005251395 | 358.211 | C12 H12 Br N3 O3 S | UEPCGMBIWLBTPP-UHFFFAOYSA-N | InChI=1S/C12H12BrN3O3S/c1-7(20-11-12(18)19-15-16(11)2)10(17)14-9-6-4-3-5-8(9)13/h3-7H,1-2H3,(H-,14,15,17,18) | CC(C(=O)Nc1ccccc1Br)Sc2c(on[n+]2C)[O-] | |
| AKOS005251396 | 358.211 | C12 H12 Br N3 O3 S | QLWLFAUZOLSAKG-UHFFFAOYSA-N | InChI=1S/C12H12BrN3O3S/c1-7(20-11-12(18)19-15-16(11)2)10(17)14-9-5-3-8(13)4-6-9/h3-7H,1-2H3,(H-,14,15,17,18) | CC(C(=O)Nc1ccc(cc1)Br)Sc2c(on[n+]2C)[O-] | |
| AKOS005252284 | 358.211 | C12 H12 Br N3 O3 S | PCNUCEKLJIEQMZ-UHFFFAOYSA-N | InChI=1S/C12H12BrN3O3S/c1-16-11(12(18)19-15-16)20-7-6-10(17)14-9-5-3-2-4-8(9)13/h2-5H,6-7H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccccc2Br | |
| AKOS005252286 | 358.211 | C12 H12 Br N3 O3 S | DPWFNKCCQUNVCG-UHFFFAOYSA-N | InChI=1S/C12H12BrN3O3S/c1-16-11(12(18)19-15-16)20-7-6-10(17)14-9-4-2-8(13)3-5-9/h2-5H,6-7H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2)Br | |
| AKOS005214977 | 265.696 | C12 H12 Cl N3 O2 | LPYWKKOWFVOZET-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O2/c1-9(17)14-12-11(7-13)16(15-18-12)8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccccc2)CCl | |
| AKOS005215682 | 265.696 | C12 H12 Cl N3 O2 | VUZXVRCKWRZKAL-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O2/c1-9-2-4-10(5-3-9)7-16-8-12(18-15-16)14-11(17)6-13/h2-5,8H,6-7H2,1H3 | Cc1ccc(cc1)C[n+]2cc(on2)[N-]C(=O)CCl | |
| AKOS005215695 | 265.696 | C12 H12 Cl N3 O2 | UHLIGCXJWVGCHY-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O2/c13-8-11(17)14-12-9-16(15-18-12)7-6-10-4-2-1-3-5-10/h1-5,9H,6-8H2 | c1ccc(cc1)CC[n+]2cc(on2)[N-]C(=O)CCl | |
| AKOS005219467 | 265.696 | C12 H12 Cl N3 O2 | WWXBSUWCPDSIRF-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O2/c1-8(2)16-10(13)12(18-15-16)14-11(17)9-6-4-3-5-7-9/h3-8H,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)Cl | |
| AKOS005252513 | 297.761 | C12 H12 Cl N3 O2 S | YETGWKAXJRVCHR-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O2S/c1-2-16-7-12(18-15-16)14-11(17)8-19-10-5-3-9(13)4-6-10/h3-7H,2,8H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2ccc(cc2)Cl | |
| AKOS005214952 | 281.695 | C12 H12 Cl N3 O3 | ZCRVYZYWOFOVPF-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O3/c1-8(18)14-12-11(7-17)16(15-19-12)6-9-4-2-3-5-10(9)13/h2-5,17H,6-7H2,1H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccccc2Cl)CO | |
| AKOS005215683 | 281.695 | C12 H12 Cl N3 O3 | RPCOOGCZCJWKOI-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O3/c1-18-10-4-2-9(3-5-10)7-16-8-12(19-15-16)14-11(17)6-13/h2-5,8H,6-7H2,1H3 | COc1ccc(cc1)C[n+]2cc(on2)[N-]C(=O)CCl | |
| AKOS005250354 | 281.695 | C12 H12 Cl N3 O3 | OPYQKESSDARRLL-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O3/c1-15(7-10-12(18)19-14-16(10)2)11(17)8-4-3-5-9(13)6-8/h3-6H,7H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)c2cccc(c2)Cl | |
| AKOS005251308 | 313.76 | C12 H12 Cl N3 O3 S | WQPAGVSCNWLTQL-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O3S/c1-7-8(13)4-3-5-9(7)14-10(17)6-20-11-12(18)19-15-16(11)2/h3-5H,6H2,1-2H3,(H-,14,15,17,18) | Cc1c(cccc1Cl)NC(=O)CSc2c(on[n+]2C)[O-] | |
| AKOS005251309 | 313.76 | C12 H12 Cl N3 O3 S | YHMJTXVFCAJUHY-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O3S/c1-7-3-4-8(5-9(7)13)14-10(17)6-20-11-12(18)19-15-16(11)2/h3-5H,6H2,1-2H3,(H-,14,15,17,18) | Cc1ccc(cc1Cl)NC(=O)CSc2c(on[n+]2C)[O-] | |
| AKOS005251333 | 313.76 | C12 H12 Cl N3 O3 S | ZSMOIZKMQFEOOU-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O3S/c1-7-3-4-8(13)5-9(7)14-10(17)6-20-11-12(18)19-15-16(11)2/h3-5H,6H2,1-2H3,(H-,14,15,17,18) | Cc1ccc(cc1NC(=O)CSc2c(on[n+]2C)[O-])Cl | |
| AKOS005251398 | 313.76 | C12 H12 Cl N3 O3 S | GHJFUCWJJJKHGQ-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O3S/c1-7(20-11-12(18)19-15-16(11)2)10(17)14-9-6-4-3-5-8(9)13/h3-7H,1-2H3,(H-,14,15,17,18) | CC(C(=O)Nc1ccccc1Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005251399 | 313.76 | C12 H12 Cl N3 O3 S | BFWBJPQJEXMZHM-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O3S/c1-7(20-11-12(18)19-15-16(11)2)10(17)14-9-5-3-4-8(13)6-9/h3-7H,1-2H3,(H-,14,15,17,18) | CC(C(=O)Nc1cccc(c1)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005251400 | 313.76 | C12 H12 Cl N3 O3 S | IUMVWXSAJLJAIZ-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O3S/c1-7(20-11-12(18)19-15-16(11)2)10(17)14-9-5-3-8(13)4-6-9/h3-7H,1-2H3,(H-,14,15,17,18) | CC(C(=O)Nc1ccc(cc1)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005252288 | 313.76 | C12 H12 Cl N3 O3 S | PPJFJZCJKKJDBU-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O3S/c1-16-11(12(18)19-15-16)20-7-6-10(17)14-9-5-3-2-4-8(9)13/h2-5H,6-7H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccccc2Cl | |
| AKOS005252289 | 313.76 | C12 H12 Cl N3 O3 S | JZQQQYXRTRUXBS-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O3S/c1-16-11(12(18)19-15-16)20-6-5-10(17)14-9-4-2-3-8(13)7-9/h2-4,7H,5-6H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cccc(c2)Cl | |
| AKOS005252290 | 313.76 | C12 H12 Cl N3 O3 S | LNDPWORCKPRBAG-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O3S/c1-16-11(12(18)19-15-16)20-7-6-10(17)14-9-4-2-8(13)3-5-9/h2-5H,6-7H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2)Cl | |
| AKOS005250513 | 297.694 | C12 H12 Cl N3 O4 | CJTVGHOEYIXLIM-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O4/c1-6-4-8(9(19-3)5-7(6)13)14-11(17)10-12(18)20-15-16(10)2/h4-5H,1-3H3,(H-,14,15,17,18) | Cc1cc(c(cc1Cl)OC)NC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005251239 | 329.759 | C12 H12 Cl N3 O4 S | LLUXHFLHJPYSEK-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O4S/c1-16-11(12(18)20-15-16)21-6-10(17)14-7-3-4-9(19-2)8(13)5-7/h3-5H,6H2,1-2H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(c(c2)Cl)OC | |
| AKOS005251240 | 329.759 | C12 H12 Cl N3 O4 S | UJALSHGKWMNLJG-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O4S/c1-16-11(12(18)20-15-16)21-6-10(17)14-8-5-7(13)3-4-9(8)19-2/h3-5H,6H2,1-2H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2cc(ccc2OC)Cl | |
| AKOS005250517 | 313.694 | C12 H12 Cl N3 O5 | ALCOFFQLHPESHD-UHFFFAOYSA-N | InChI=1S/C12H12ClN3O5/c1-16-10(12(18)21-15-16)11(17)14-7-4-6(13)8(19-2)5-9(7)20-3/h4-5H,1-3H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])C(=O)Nc2cc(c(cc2OC)OC)Cl | |
| AKOS005215077 | 315.155 | C12 H12 Cl2 N4 O2 | VCYFDLLCFZVSNZ-UHFFFAOYSA-N | InChI=1S/C12H12Cl2N4O2/c1-7(19)16-12-11(5-15)18(17-20-12)6-8-2-3-9(13)4-10(8)14/h2-4H,5-6,15H2,1H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2Cl)Cl)CN | |
| AKOS005214939 | 265.24 | C12 H12 F N3 O3 | CYTYEJSXJHECDP-UHFFFAOYSA-N | InChI=1S/C12H12FN3O3/c1-8(18)14-12-11(7-17)16(15-19-12)6-9-2-4-10(13)5-3-9/h2-5,17H,6-7H2,1H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2)F)CO | |
| AKOS005250245 | 265.24 | C12 H12 F N3 O3 | HMNZHOVDXLUDCV-UHFFFAOYSA-N | InChI=1S/C12H12FN3O3/c1-15(7-10-12(18)19-14-16(10)2)11(17)8-5-3-4-6-9(8)13/h3-6H,7H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)c2ccccc2F | |
| AKOS005250352 | 265.24 | C12 H12 F N3 O3 | AMASDYOETSJLNT-UHFFFAOYSA-N | InChI=1S/C12H12FN3O3/c1-15(7-10-12(18)19-14-16(10)2)11(17)8-3-5-9(13)6-4-8/h3-6H,7H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)c2ccc(cc2)F | |
| AKOS005251493 | 297.305 | C12 H12 F N3 O3 S | FRHPOJKAVSQVLZ-UHFFFAOYSA-N | InChI=1S/C12H12FN3O3S/c1-7(20-11-12(18)19-15-16(11)2)10(17)14-9-6-4-3-5-8(9)13/h3-7H,1-2H3,(H-,14,15,17,18) | CC(C(=O)Nc1ccccc1F)Sc2c(on[n+]2C)[O-] | |
| AKOS005251494 | 297.305 | C12 H12 F N3 O3 S | GRDNTOKALHMFQC-UHFFFAOYSA-N | InChI=1S/C12H12FN3O3S/c1-7(20-11-12(18)19-15-16(11)2)10(17)14-9-5-3-8(13)4-6-9/h3-7H,1-2H3,(H-,14,15,17,18) | CC(C(=O)Nc1ccc(cc1)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005252319 | 297.305 | C12 H12 F N3 O3 S | RWYMWPMIQRCYQJ-UHFFFAOYSA-N | InChI=1S/C12H12FN3O3S/c1-16-11(12(18)19-15-16)20-7-6-10(17)14-9-5-3-2-4-8(9)13/h2-5H,6-7H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccccc2F | |
| AKOS005252320 | 297.305 | C12 H12 F N3 O3 S | YNPIRFZRRFVFRA-UHFFFAOYSA-N | InChI=1S/C12H12FN3O3S/c1-16-11(12(18)19-15-16)20-7-6-10(17)14-9-4-2-8(13)3-5-9/h2-5H,6-7H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2)F | |
| AKOS005251502 | 405.211 | C12 H12 I N3 O3 S | XDLYYDKJEDGTQW-UHFFFAOYSA-N | InChI=1S/C12H12IN3O3S/c1-7(20-11-12(18)19-15-16(11)2)10(17)14-9-5-3-8(13)4-6-9/h3-7H,1-2H3,(H-,14,15,17,18) | CC(C(=O)Nc1ccc(cc1)I)Sc2c(on[n+]2C)[O-] | |
| AKOS005252329 | 405.211 | C12 H12 I N3 O3 S | FUVRFCLOQXZDCX-UHFFFAOYSA-N | InChI=1S/C12H12IN3O3S/c1-16-11(12(18)19-15-16)20-7-6-10(17)14-9-4-2-8(13)3-5-9/h2-5H,6-7H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2)I | |
| AKOS005215728 | 216.236 | C12 H12 N2 O2 | XDTJFVDUWHVEER-UHFFFAOYSA-N | InChI=1S/C12H12N2O2/c1-2-3-9-14-11(12(15)16-13-14)10-7-5-4-6-8-10/h2,4-8H,1,3,9H2 | C=CCC[n+]1c(c(on1)[O-])c2ccccc2 | MFCD09881652 |
| AKOS005219527 | 264.3 | C12 H12 N2 O3 S | LZOCOMXORRRHEK-UHFFFAOYSA-N | InChI=1S/C12H12N2O3S/c1-8-3-5-9(6-4-8)18-7-10(15)11-12(16)17-13-14(11)2/h3-6H,7H2,1-2H3 | Cc1ccc(cc1)SCC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005250688 | 264.3 | C12 H12 N2 O3 S | CWPQQSLOXPKGKF-UHFFFAOYSA-N | InChI=1S/C12H12N2O3S/c1-14-11(12(16)17-13-14)10(15)8-18-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSCc2ccccc2 | |
| AKOS005219537 | 280.3 | C12 H12 N2 O4 S | YQPHUSBUPYHVPR-UHFFFAOYSA-N | InChI=1S/C12H12N2O4S/c1-2-17-10(15)8-19-11-12(16)18-13-14(11)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3 | CCOC(=O)CSc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005215593 | 260.249 | C12 H12 N4 O3 | PPTAOVGWQGFYCC-UHFFFAOYSA-N | InChI=1S/C12H12N4O3/c1-15(2)16-10(8-17)12(19-14-16)13-11(18)9-6-4-3-5-7-9/h3-8H,1-2H3 | CN(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)C=O | |
| AKOS005219742 | 276.248 | C12 H12 N4 O4 | KFSMBXZSKMYILI-UHFFFAOYSA-N | InChI=1S/C12H12N4O4/c1-5(17)8-6(2)19-11(14)7(4-13)9(8)10-12(18)20-15-16(10)3/h9H,14H2,1-3H3 | CC1=C(C(C(=C(O1)N)C#N)c2c(on[n+]2C)[O-])C(=O)C | |
| AKOS005250544 | 276.248 | C12 H12 N4 O4 | DFLYIYCCEOZYNC-UHFFFAOYSA-N | InChI=1S/C12H12N4O4/c1-7(17)13-8-3-5-9(6-4-8)14-11(18)10-12(19)20-15-16(10)2/h3-6,15H,1-2H3,(H,18,19) | CC(=O)Nc1ccc(cc1)NC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005251118 | 308.313 | C12 H12 N4 O4 S | IDNOMIQLBXSEDH-UHFFFAOYSA-N | InChI=1S/C12H12N4O4S/c1-16-11(12(19)20-15-16)21-6-9(17)14-8-4-2-7(3-5-8)10(13)18/h2-5H,6H2,1H3,(H3-,13,14,15,17,18,19) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)C(=O)N | |
| AKOS005251119 | 308.313 | C12 H12 N4 O4 S | GRPPMXFCJWFJCP-UHFFFAOYSA-N | InChI=1S/C12H12N4O4S/c1-16-11(12(19)20-15-16)21-6-9(17)14-8-5-3-2-4-7(8)10(13)18/h2-5H,6H2,1H3,(H3-,13,14,15,17,18,19) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccccc2C(=O)N | |
| AKOS005250363 | 292.247 | C12 H12 N4 O5 | ACDUHXIIOLKNTD-UHFFFAOYSA-N | InChI=1S/C12H12N4O5/c1-14(7-10-12(18)21-13-15(10)2)11(17)8-4-3-5-9(6-8)16(19)20/h3-6H,7H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)c2cccc(c2)[N+](=O)[O-] | |
| AKOS005250364 | 292.247 | C12 H12 N4 O5 | FEYXKWNPIPTPCV-UHFFFAOYSA-N | InChI=1S/C12H12N4O5/c1-14(7-10-12(18)21-13-15(10)2)11(17)8-3-5-9(6-4-8)16(19)20/h3-6H,7H2,1-2H3/q-2 | C[n+]1c(c(on1)[O-])CN(C)C(=O)c2ccc(cc2)[N-](=O)[O-] | |
| AKOS005251247 | 324.312 | C12 H12 N4 O5 S | IXIWADXIGOOOAX-UHFFFAOYSA-N | InChI=1S/C12H12N4O5S/c1-7-5-8(16(19)20)3-4-9(7)13-10(17)6-22-11-12(18)21-14-15(11)2/h3-5H,6H2,1-2H3,(H-,13,14,17,18) | Cc1cc(ccc1NC(=O)CSc2c(on[n+]2C)[O-])[N+](=O)[O-] | |
| AKOS005251248 | 324.312 | C12 H12 N4 O5 S | GRGKNQDCIAHWJC-UHFFFAOYSA-N | InChI=1S/C12H12N4O5S/c1-7-3-4-8(16(19)20)5-9(7)13-10(17)6-22-11-12(18)21-14-15(11)2/h3-5H,6H2,1-2H3,(H-,13,14,17,18) | Cc1ccc(cc1NC(=O)CSc2c(on[n+]2C)[O-])[N+](=O)[O-] | |
| AKOS005250105 | 320.327 | C12 H12 N6 O3 S | MJLUTDXKDPSRME-UHFFFAOYSA-N | InChI=1S/C12H12N6O3S/c1-20-7-4-2-6(3-5-7)18-8(10(19)21-17-18)9-14-11(13)16-12(22)15-9/h2-5,9H,1H3,(H4-,13,14,15,16,17,19,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C3NC(=NC(=N3)N)S | |
| AKOS005214863 | 280.71 | C12 H13 Cl N4 O2 | ZIMZCEOYRIPOTO-UHFFFAOYSA-N | InChI=1S/C12H13ClN4O2/c1-8(18)15-12-11(6-14)17(16-19-12)7-9-4-2-3-5-10(9)13/h2-5H,6-7,14H2,1H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccccc2Cl)CN | |
| AKOS005252677 | 312.775 | C12 H13 Cl N4 O2 S | OPUWPWDGUWPGJC-UHFFFAOYSA-N | InChI=1S/C12H13ClN4O2S/c1-16(2)17-7-12(19-15-17)14-11(18)8-20-10-5-3-9(13)4-6-10/h3-7H,8H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2ccc(cc2)Cl | |
| AKOS005214336 | 302.157 | C12 H13 Cl2 N3 O2 | WILYGLACGLIZGZ-UHFFFAOYSA-N | InChI=1S/C12H13Cl2N3O2/c1-17-11(12(18)19-16-17)7-15-5-4-8-2-3-9(13)6-10(8)14/h2-3,6,15H,4-5,7H2,1H3 | C[n+]1c(c(on1)[O-])CNCCc2ccc(cc2Cl)Cl | |
| AKOS005215078 | 264.256 | C12 H13 F N4 O2 | UUOQKWSQOSLZIT-UHFFFAOYSA-N | InChI=1S/C12H13FN4O2/c1-8(18)15-12-11(6-14)17(16-19-12)7-9-2-4-10(13)5-3-9/h2-5H,6-7,14H2,1H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2)F)CN | |
| AKOS005214157 | 231.251 | C12 H13 N3 O2 | WFTVDGZOYHJZQA-UHFFFAOYSA-N | InChI=1S/C12H13N3O2/c1-2-8-13-9-11-12(16)17-14-15(11)10-6-4-3-5-7-10/h2-7,13H,1,8-9H2 | C=CCNCc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005214318 | 231.251 | C12 H13 N3 O2 | YDQMZWOLYHZANP-UHFFFAOYSA-N | InChI=1S/C12H13N3O2/c16-12-11(8-13-9-6-7-9)15(14-17-12)10-4-2-1-3-5-10/h1-5,9,13H,6-8H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC3 | |
| AKOS005215473 | 231.251 | C12 H13 N3 O2 | FFGGAXRNIDFSGS-UHFFFAOYSA-N | InChI=1S/C12H13N3O2/c1-9(2)15-8-11(17-14-15)13-12(16)10-6-4-3-5-7-10/h3-9H,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)c2ccccc2 | MFCD09881636 |
| AKOS005215543 | 231.251 | C12 H13 N3 O2 | NPZHWJLMKDFLHI-UHFFFAOYSA-N | InChI=1S/C12H13N3O2/c1-9-3-5-11(6-4-9)7-15-8-12(17-14-15)13-10(2)16/h3-6,8H,7H2,1-2H3 | Cc1ccc(cc1)C[n+]2cc(on2)[N-]C(=O)C | |
| AKOS005215556 | 231.251 | C12 H13 N3 O2 | YPFATSUBXQGRQQ-UHFFFAOYSA-N | InChI=1S/C12H13N3O2/c1-10(16)13-12-9-15(14-17-12)8-7-11-5-3-2-4-6-11/h2-6,9H,7-8H2,1H3 | CC(=O)[N-]c1c[n+](no1)CCc2ccccc2 | |
| AKOS005215586 | 263.316 | C12 H13 N3 O2 S | PDPRXMBMVTZNND-AATRIKPKSA-N | InChI=1S/C12H13N3O2S/c1-9(2)15-8-12(17-14-15)13-11(16)6-5-10-4-3-7-18-10/h3-9H,1-2H3/b6-5+ | CC(C)[n+]1cc(on1)[N-]C(=O)/C=C/c2cccs2 | |
| AKOS005252444 | 263.316 | C12 H13 N3 O2 S | IYOFATGNCUAFBY-UHFFFAOYSA-N | InChI=1S/C12H13N3O2S/c1-2-15-8-12(17-14-15)13-11(16)9-18-10-6-4-3-5-7-10/h3-8H,2,9H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2ccccc2 | |
| AKOS005252604 | 263.316 | C12 H13 N3 O2 S | UDXKIXLQDSOMQU-UHFFFAOYSA-N | InChI=1S/C12H13N3O2S/c1-15-7-12(17-14-15)13-11(16)9-18-8-10-5-3-2-4-6-10/h2-7H,8-9H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSCc2ccccc2 | |
| AKOS005252626 | 263.316 | C12 H13 N3 O2 S | CXKBYBNFCHPTJG-UHFFFAOYSA-N | InChI=1S/C12H13N3O2S/c1-9-3-5-10(6-4-9)18-8-11(16)13-12-7-15(2)14-17-12/h3-7H,8H2,1-2H3 | Cc1ccc(cc1)SCC(=O)[N-]c2c[n+](no2)C | |
| AKOS005214926 | 247.25 | C12 H13 N3 O3 | APBFQZPQTYRGPC-UHFFFAOYSA-N | InChI=1S/C12H13N3O3/c1-9(17)13-12-11(8-16)15(14-18-12)7-10-5-3-2-4-6-10/h2-6,16H,7-8H2,1H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccccc2)CO | |
| AKOS005215504 | 247.25 | C12 H13 N3 O3 | LXXXCQHJSGOZCY-UHFFFAOYSA-N | InChI=1S/C12H13N3O3/c1-17-8-7-15-9-11(18-14-15)13-12(16)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)c2ccccc2 | |
| AKOS005215532 | 247.25 | C12 H13 N3 O3 | NATQSKIHKVZKGY-UHFFFAOYSA-N | InChI=1S/C12H13N3O3/c1-8(16)13-12-11(15(2)14-18-12)9-5-4-6-10(7-9)17-3/h4-7H,1-3H3 | CC(=O)[N-]c1c([n+](no1)C)c2cccc(c2)OC | |
| AKOS005215544 | 247.25 | C12 H13 N3 O3 | QPUHKQCVSKLPNQ-UHFFFAOYSA-N | InChI=1S/C12H13N3O3/c1-9(16)13-12-8-15(14-18-12)7-10-3-5-11(17-2)6-4-10/h3-6,8H,7H2,1-2H3 | CC(=O)[N-]c1c[n+](no1)Cc2ccc(cc2)OC | |
| AKOS005250369 | 247.25 | C12 H13 N3 O3 | HUZUZWSOBCETIR-UHFFFAOYSA-N | InChI=1S/C12H13N3O3/c1-9(16)14(2)8-11-12(17)18-13-15(11)10-6-4-3-5-7-10/h3-7H,8H2,1-2H3 | CC(=O)N(C)Cc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005250523 | 247.25 | C12 H13 N3 O3 | GGFJXHTUCCLQPA-UHFFFAOYSA-N | InChI=1S/C12H13N3O3/c1-7-5-4-6-8(2)9(7)13-11(16)10-12(17)18-14-15(10)3/h4-6H,1-3H3,(H-,13,14,16,17) | Cc1cccc(c1NC(=O)c2c(on[n+]2C)[O-])C | |
| AKOS005250638 | 247.25 | C12 H13 N3 O3 | QPTNJEZHEMWAPJ-UHFFFAOYSA-N | InChI=1S/C12H13N3O3/c1-7-5-4-6-9(8(7)2)13-11(16)10-12(17)18-14-15(10)3/h4-6H,1-3H3,(H-,13,14,16,17) | Cc1cccc(c1C)NC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005250639 | 247.25 | C12 H13 N3 O3 | SBYOKSIBQYRIAQ-UHFFFAOYSA-N | InChI=1S/C12H13N3O3/c1-7-4-5-9(8(2)6-7)13-11(16)10-12(17)18-14-15(10)3/h4-6H,1-3H3,(H-,13,14,16,17) | Cc1ccc(c(c1)C)NC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005250649 | 247.25 | C12 H13 N3 O3 | AQWQZDBQSUBLAZ-UHFFFAOYSA-N | InChI=1S/C12H13N3O3/c1-7-4-5-8(2)9(6-7)13-11(16)10-12(17)18-14-15(10)3/h4-6H,1-3H3,(H-,13,14,16,17) | Cc1ccc(c(c1)NC(=O)c2c(on[n+]2C)[O-])C | |
| AKOS005250650 | 247.25 | C12 H13 N3 O3 | SURAIOCZSWORJF-UHFFFAOYSA-N | InChI=1S/C12H13N3O3/c1-7-4-5-9(6-8(7)2)13-11(16)10-12(17)18-14-15(10)3/h4-6H,1-3H3,(H-,13,14,16,17) | Cc1ccc(cc1C)NC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005250651 | 247.25 | C12 H13 N3 O3 | NDHXALGBIUVZQL-UHFFFAOYSA-N | InChI=1S/C12H13N3O3/c1-7-4-8(2)6-9(5-7)13-11(16)10-12(17)18-14-15(10)3/h4-6H,1-3H3,(H-,13,14,16,17) | Cc1cc(cc(c1)NC(=O)c2c(on[n+]2C)[O-])C | |
| AKOS005251241 | 279.315 | C12 H13 N3 O3 S | HQQIVBRHBJXDRJ-UHFFFAOYSA-N | InChI=1S/C12H13N3O3S/c1-8-5-3-4-6-9(8)13-10(16)7-19-11-12(17)18-14-15(11)2/h3-6H,7H2,1-2H3,(H-,13,14,16,17) | Cc1ccccc1NC(=O)CSc2c(on[n+]2C)[O-] | |
| AKOS005251242 | 279.315 | C12 H13 N3 O3 S | RYAQWXJIHGDBHY-UHFFFAOYSA-N | InChI=1S/C12H13N3O3S/c1-8-4-3-5-9(6-8)13-10(16)7-19-11-12(17)18-14-15(11)2/h3-6H,7H2,1-2H3,(H-,13,14,16,17) | Cc1cccc(c1)NC(=O)CSc2c(on[n+]2C)[O-] | |
| AKOS005251243 | 279.315 | C12 H13 N3 O3 S | UBGMVTNYGVEGDW-UHFFFAOYSA-N | InChI=1S/C12H13N3O3S/c1-8-3-5-9(6-4-8)13-10(16)7-19-11-12(17)18-14-15(11)2/h3-6H,7H2,1-2H3,(H-,13,14,16,17) | Cc1ccc(cc1)NC(=O)CSc2c(on[n+]2C)[O-] | |
| AKOS005251392 | 279.315 | C12 H13 N3 O3 S | JJQLZZQGRKBZHF-UHFFFAOYSA-N | InChI=1S/C12H13N3O3S/c1-8(19-11-12(17)18-14-15(11)2)10(16)13-9-6-4-3-5-7-9/h3-8H,1-2H3,(H-,13,14,16,17) | CC(C(=O)Nc1ccccc1)Sc2c(on[n+]2C)[O-] | |
| AKOS005252281 | 279.315 | C12 H13 N3 O3 S | MHCPXBCNWGJITJ-UHFFFAOYSA-N | InChI=1S/C12H13N3O3S/c1-15-11(12(17)18-14-15)19-8-7-10(16)13-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccccc2 | |
| AKOS005214277 | 263.249 | C12 H13 N3 O4 | XOWBWMMDKSOTJS-UHFFFAOYSA-N | InChI=1S/C12H13N3O4/c1-15-9(12(16)19-14-15)6-13-5-8-2-3-10-11(4-8)18-7-17-10/h2-4,13H,5-7H2,1H3 | C[n+]1c(c(on1)[O-])CNCc2ccc3c(c2)OCO3 | |
| AKOS005250534 | 263.249 | C12 H13 N3 O4 | NOGBFMCFPRRBOQ-UHFFFAOYSA-N | InChI=1S/C12H13N3O4/c1-3-18-9-7-5-4-6-8(9)13-11(16)10-12(17)19-14-15(10)2/h4-7H,3H2,1-2H3,(H-,13,14,16,17) | CCOc1ccccc1NC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005250535 | 263.249 | C12 H13 N3 O4 | MGXSBPAIDYCILU-UHFFFAOYSA-N | InChI=1S/C12H13N3O4/c1-3-18-9-6-4-8(5-7-9)13-11(16)10-12(17)19-14-15(10)2/h4-7H,3H2,1-2H3,(H-,13,14,16,17) | CCOc1ccc(cc1)NC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005251109 | 295.314 | C12 H13 N3 O4 S | KTIZWCHRKXJSMN-UHFFFAOYSA-N | InChI=1S/C12H13N3O4S/c1-15-11(12(17)19-14-15)20-7-10(16)13-8-5-3-4-6-9(8)18-2/h3-6H,7H2,1-2H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccccc2OC | |
| AKOS005251110 | 295.314 | C12 H13 N3 O4 S | SEHQPABINUCJCI-UHFFFAOYSA-N | InChI=1S/C12H13N3O4S/c1-15-11(12(17)19-14-15)20-7-10(16)13-8-4-3-5-9(6-8)18-2/h3-6H,7H2,1-2H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2cccc(c2)OC | |
| AKOS005251223 | 295.314 | C12 H13 N3 O4 S | XIFSBYRRBSPZDL-UHFFFAOYSA-N | InChI=1S/C12H13N3O4S/c1-15-11(12(17)19-14-15)20-7-10(16)13-8-3-5-9(18-2)6-4-8/h3-6H,7H2,1-2H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)OC | |
| AKOS005250520 | 279.249 | C12 H13 N3 O5 | LPRNFPWCDQQIKG-UHFFFAOYSA-N | InChI=1S/C12H13N3O5/c1-15-10(12(17)20-14-15)11(16)13-8-5-4-7(18-2)6-9(8)19-3/h4-6H,1-3H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2OC)OC | |
| AKOS005250521 | 279.249 | C12 H13 N3 O5 | YWZXXJPMSZTOCZ-UHFFFAOYSA-N | InChI=1S/C12H13N3O5/c1-15-10(12(17)20-14-15)11(16)13-8-6-7(18-2)4-5-9(8)19-3/h4-6H,1-3H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])C(=O)Nc2cc(ccc2OC)OC | |
| AKOS005250522 | 279.249 | C12 H13 N3 O5 | HJVZNAMRXSVSFK-UHFFFAOYSA-N | InChI=1S/C12H13N3O5/c1-15-10(12(17)20-14-15)11(16)13-7-4-8(18-2)6-9(5-7)19-3/h4-6H,1-3H3,(H-,13,14,16,17) | C[n+]1c(c(on1)[O-])C(=O)Nc2cc(cc(c2)OC)OC | |
| AKOS005250655 | 279.249 | C12 H13 N3 O5 | IHQGQQATHHDCTL-UHFFFAOYSA-N | InChI=1S/C12H13N3O5/c1-19-9-4-2-8(3-5-9)15-10(12(18)20-14-15)11(17)13-6-7-16/h2-5,16H,6-7H2,1H3,(H-,13,14,17,18) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCCO | |
| AKOS005214251 | 267.711 | C12 H14 Cl N3 O2 | LLQZSJSQOCKSKK-UHFFFAOYSA-N | InChI=1S/C12H14ClN3O2/c1-16-11(12(17)18-15-16)8-14-6-5-9-3-2-4-10(13)7-9/h2-4,7,14H,5-6,8H2,1H3 | C[n+]1c(c(on1)[O-])CNCCc2cccc(c2)Cl | |
| AKOS005214334 | 267.711 | C12 H14 Cl N3 O2 | BPRKDRGDJGKLNU-UHFFFAOYSA-N | InChI=1S/C12H14ClN3O2/c1-16-11(12(17)18-15-16)8-14-7-6-9-4-2-3-5-10(9)13/h2-5,14H,6-8H2,1H3 | C[n+]1c(c(on1)[O-])CNCCc2ccccc2Cl | |
| AKOS005214335 | 267.711 | C12 H14 Cl N3 O2 | QZJRMFWNFRJKEO-UHFFFAOYSA-N | InChI=1S/C12H14ClN3O2/c1-16-11(12(17)18-15-16)8-14-7-6-9-2-4-10(13)5-3-9/h2-5,14H,6-8H2,1H3 | C[n+]1c(c(on1)[O-])CNCCc2ccc(cc2)Cl | |
| AKOS005214326 | 251.257 | C12 H14 F N3 O2 | CCHHOHZYRCINIG-UHFFFAOYSA-N | InChI=1S/C12H14FN3O2/c1-16-11(12(17)18-15-16)8-14-7-6-9-2-4-10(13)5-3-9/h2-5,14H,6-8H2,1H3 | C[n+]1c(c(on1)[O-])CNCCc2ccc(cc2)F | |
| AKOS005214327 | 251.257 | C12 H14 F N3 O2 | WJTAISZKJLUJPZ-UHFFFAOYSA-N | InChI=1S/C12H14FN3O2/c1-16-11(12(17)18-15-16)8-14-7-6-9-4-2-3-5-10(9)13/h2-5,14H,6-8H2,1H3 | C[n+]1c(c(on1)[O-])CNCCc2ccccc2F | |
| AKOS005215064 | 246.265 | C12 H14 N4 O2 | YIWGGWJDNMMJKE-UHFFFAOYSA-N | InChI=1S/C12H14N4O2/c1-9(17)14-12-11(7-13)16(15-18-12)8-10-5-3-2-4-6-10/h2-6H,7-8,13H2,1H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccccc2)CN | |
| AKOS005215587 | 278.33 | C12 H14 N4 O2 S | RRTGUKPKWNDWLD-UHFFFAOYSA-N | InChI=1S/C12H14N4O2S/c1-15(2)16-12(19-3)11(18-14-16)13-10(17)9-7-5-4-6-8-9/h4-8H,1-3H3 | CN(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)SC | |
| AKOS005219854 | 278.33 | C12 H14 N4 O2 S | MWPKRJALCHGIMJ-UHFFFAOYSA-N | InChI=1S/C12H14N4O2S/c1-15(8-10-11(17)18-14-16(10)2)12(19)13-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H-,13,14,17,19) | C[n+]1c(c(on1)[O-])CN(C)C(=S)Nc2ccccc2 | |
| AKOS005219884 | 278.33 | C12 H14 N4 O2 S | YLAOPHBKNLXOHB-UHFFFAOYSA-N | InChI=1S/C12H14N4O2S/c1-13-12(19)15(2)8-10-11(17)18-14-16(10)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H-,13,14,17,19) | CNC(=S)N(C)Cc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005252682 | 278.33 | C12 H14 N4 O2 S | DBAKSFABVJNZSE-UHFFFAOYSA-N | InChI=1S/C12H14N4O2S/c1-15(2)16-8-12(18-14-16)13-11(17)9-19-10-6-4-3-5-7-10/h3-8H,9H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2ccccc2 | |
| AKOS005252822 | 278.33 | C12 H14 N4 O2 S | KENKODFEUTZWGF-UHFFFAOYSA-N | InChI=1S/C12H14N4O2S/c1-2-16-7-12(18-15-16)14-11(17)8-19-10-5-3-4-9(13)6-10/h3-7H,2,8,13H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2cccc(c2)N | |
| AKOS005252829 | 278.33 | C12 H14 N4 O2 S | SLDOPTHOBZOCHB-UHFFFAOYSA-N | InChI=1S/C12H14N4O2S/c1-9(2)16-7-11(18-15-16)14-10(17)8-19-12-5-3-4-6-13-12/h3-7,9H,8H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2ccccn2 | |
| AKOS005253348 | 294.33 | C12 H14 N4 O3 S | MVDUDFHOAQOXOZ-UHFFFAOYSA-N | InChI=1S/C12H14N4O3S/c1-18-7-6-16-8-11(19-15-16)14-10(17)9-20-12-4-2-3-5-13-12/h2-5,8H,6-7,9H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2ccccn2 | |
| AKOS005215595 | 310.329 | C12 H14 N4 O4 S | KWNSAPFZTQVDMD-UHFFFAOYSA-N | InChI=1S/C12H14N4O4S/c1-9-4-6-10(7-5-9)21(18,19)13-12-11(8-17)16(14-20-12)15(2)3/h4-8H,1-3H3 | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)N(C)C)C=O | |
| AKOS005251456 | 358.393 | C12 H14 N4 O5 S2 | BKSASEWQHKHGFC-UHFFFAOYSA-N | InChI=1S/C12H14N4O5S2/c1-7(22-11-12(18)21-15-16(11)2)10(17)14-8-3-5-9(6-4-8)23(13,19)20/h3-7H,1-2H3,(H3-,13,14,15,17,18,19,20) | CC(C(=O)Nc1ccc(cc1)S(=O)(=O)N)Sc2c(on[n+]2C)[O-] | |
| AKOS005252381 | 358.393 | C12 H14 N4 O5 S2 | SPKULBGOMZTEIB-UHFFFAOYSA-N | InChI=1S/C12H14N4O5S2/c1-16-11(12(18)21-15-16)22-7-6-10(17)14-8-2-4-9(5-3-8)23(13,19)20/h2-5H,6-7H2,1H3,(H3-,13,14,15,17,18,19,20) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2)S(=O)(=O)N | |
| AKOS005252934 | 322.343 | C12 H14 N6 O3 S | PVMNUQFQQOYGJN-UHFFFAOYSA-N | InChI=1S/C12H14N6O3S/c19-10(9-22-12-13-2-1-3-14-12)15-11-8-18(16-21-11)17-4-6-20-7-5-17/h1-3,8H,4-7,9H2 | c1cnc(nc1)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3 | |
| AKOS005253032 | 354.342 | C12 H14 N6 O5 S | UFMZHDZMBNFOOE-UHFFFAOYSA-N | InChI=1S/C12H14N6O5S/c19-8-5-9(20)15-12(14-8)24-7-10(21)13-11-6-18(16-23-11)17-1-3-22-4-2-17/h5-6H,1-4,7H2,(H2-,13,14,15,16,19,20,21) | c1c(nc(nc1O)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3)O | |
| AKOS005214265 | 233.266 | C12 H15 N3 O2 | HWXRBBZMYOILHR-UHFFFAOYSA-N | InChI=1S/C12H15N3O2/c1-9(10-6-4-3-5-7-10)13-8-11-12(16)17-14-15(11)2/h3-7,9,13H,8H2,1-2H3 | CC(c1ccccc1)NCc2c(on[n+]2C)[O-] | |
| AKOS005214275 | 233.266 | C12 H15 N3 O2 | BEYTWVVJDUPKBS-UHFFFAOYSA-N | InChI=1S/C12H15N3O2/c1-9-3-5-10(6-4-9)7-13-8-11-12(16)17-14-15(11)2/h3-6,13H,7-8H2,1-2H3 | Cc1ccc(cc1)CNCc2c(on[n+]2C)[O-] | |
| AKOS005214276 | 233.266 | C12 H15 N3 O2 | PZWHBWDOHMLDKS-UHFFFAOYSA-N | InChI=1S/C12H15N3O2/c1-15-11(12(16)17-14-15)9-13-8-7-10-5-3-2-4-6-10/h2-6,13H,7-9H2,1H3 | C[n+]1c(c(on1)[O-])CNCCc2ccccc2 | |
| AKOS005219452 | 233.266 | C12 H15 N3 O2 | OUTUJFOQRTZGIN-UHFFFAOYSA-N | InChI=1S/C12H15N3O2/c1-9(2)13-8-11-12(16)17-14-15(11)10-6-4-3-5-7-10/h3-7,9,13H,8H2,1-2H3 | CC(C)NCc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005215597 | 269.727 | C12 H15 N3 O2 . Cl H | SAVFWCIAVNWUEJ-UHFFFAOYSA-N | InChI=1S/C12H15N3O2.ClH/c1-9(2)13-8-11-12(16)17-14-15(11)10-6-4-3-5-7-10;/h3-7,9,13H,8H2,1-2H3;1H | CC(C)NCc1c(on[n+]1c2ccccc2)[O-].Cl | |
| AKOS005214797 | 249.266 | C12 H15 N3 O3 | YLYJXLWFLQZJOR-UHFFFAOYSA-N | InChI=1S/C12H15N3O3/c1-9-2-4-10(5-3-9)15-11(8-13-6-7-16)12(17)18-14-15/h2-5,13,16H,6-8H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCO | |
| AKOS005215423 | 281.331 | C12 H15 N3 O3 S | ZRFTUDIMELQWOD-UHFFFAOYSA-N | InChI=1S/C12H15N3O3S/c1-9(2)15-8-12(18-14-15)13-19(16,17)11-6-4-10(3)5-7-11/h4-9H,1-3H3 | Cc1ccc(cc1)S(=O)(=O)[N-]c2c[n+](no2)C(C)C | |
| AKOS005252858 | 281.331 | C12 H15 N3 O3 S | QFXJFPHGTPWBJK-UHFFFAOYSA-N | InChI=1S/C12H15N3O3S/c1-9(2)15-6-12(18-14-15)13-11(16)8-19-7-10-4-3-5-17-10/h3-6,9H,7-8H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSCc2ccco2 | |
| AKOS005214814 | 265.265 | C12 H15 N3 O4 | ROODHNNFLCFHJL-UHFFFAOYSA-N | InChI=1S/C12H15N3O4/c1-18-10-4-2-9(3-5-10)15-11(8-13-6-7-16)12(17)19-14-15/h2-5,13,16H,6-8H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCO | |
| AKOS005215516 | 297.33 | C12 H15 N3 O4 S | YTCJXQXRALKDNO-UHFFFAOYSA-N | InChI=1S/C12H15N3O4S/c1-10-3-5-11(6-4-10)20(16,17)13-12-9-15(14-19-12)7-8-18-2/h3-6,9H,7-8H2,1-2H3 | Cc1ccc(cc1)S(=O)(=O)[N-]c2c[n+](no2)CCOC | |
| AKOS005253391 | 297.33 | C12 H15 N3 O4 S | GEFDIVFZVYJOSQ-UHFFFAOYSA-N | InChI=1S/C12H15N3O4S/c1-17-6-4-15-7-12(19-14-15)13-11(16)9-20-8-10-3-2-5-18-10/h2-3,5,7H,4,6,8-9H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSCc2ccco2 | |
| AKOS005252505 | 293.345 | C12 H15 N5 O2 S | QHONTPBKSVYYGB-UHFFFAOYSA-N | InChI=1S/C12H15N5O2S/c1-4-17-6-11(19-16-17)15-10(18)7-20-12-13-8(2)5-9(3)14-12/h5-6H,4,7H2,1-3H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)C)C | |
| AKOS005253137 | 293.345 | C12 H15 N5 O2 S | ZLHYZXTYQNXMSD-UHFFFAOYSA-N | InChI=1S/C12H15N5O2S/c1-16(2)17-7-12(19-15-17)14-11(18)8-20-10-5-3-4-9(13)6-10/h3-7H,8,13H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2cccc(c2)N | |
| AKOS005215664 | 248.353 | C12 H16 N2 O2 Si | GDFCEDUOTZGUCK-UHFFFAOYSA-N | InChI=1S/C12H16N2O2Si/c1-17(2,3)9-14-11(12(15)16-13-14)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3 | C[Si](C)(C)C[n+]1c(c(on1)[O-])c2ccccc2 | MFCD09881649 |
| AKOS005215562 | 285.727 | C12 H16 N3 O3 . Cl | IFXCFKKPCYIYIU-UHFFFAOYSA-M | InChI=1S/C12H16N3O3.ClH/c1-16-10-4-3-9(7-11(10)17-2)5-6-15-8-12(13)18-14-15;/h3-4,7-8H,5-6,13H2,1-2H3;1H/q+1;/p-1 | COc1ccc(cc1OC)CC[n+]2cc(on2)N.[Cl-] | |
| AKOS005214256 | 248.281 | C12 H16 N4 O2 | WTXGRKXJTSPOFQ-UHFFFAOYSA-N | InChI=1S/C12H16N4O2/c1-9(2)16-11(12(17)18-15-16)8-14-7-10-4-3-5-13-6-10/h3-6,9,14H,7-8H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCc2cccnc2 | |
| AKOS005252821 | 280.346 | C12 H16 N4 O2 S | NCUXIIUUJJZYSL-UHFFFAOYSA-N | InChI=1S/C12H16N4O2S/c1-2-16-7-12(18-15-16)14-11(17)8-19-10-5-3-9(13)4-6-10/h3,5,7H,2,4,6,8,13H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSC2=CC=C(CC2)N | |
| AKOS005215673 | 296.345 | C12 H16 N4 O3 S | ZEBZTWMLPDDBDJ-UHFFFAOYSA-N | InChI=1S/C12H16N4O3S/c1-12(2,3)11(18)14-9-7(16(4)15-19-9)8(17)10-13-5-6-20-10/h5-6,8,17H,1-4H3 | CC(C)(C)C(=O)[N-]c1c([n+](no1)C)C(c2nccs2)O | |
| AKOS005215660 | 280.28 | C12 H16 N4 O4 | RYMYAGVUNWYFJG-UHFFFAOYSA-N | InChI=1S/C12H16N4O4/c1-8(17)13-12-10(11(18)9-2-3-9)16(14-20-12)15-4-6-19-7-5-15/h9H,2-7H2,1H3 | CC(=O)[N-]c1c([n+](no1)N2CCOCC2)C(=O)C3CC3 | |
| AKOS005214314 | 312.345 | C12 H16 N4 O4 S | DARGYZJGDWZQBE-UHFFFAOYSA-N | InChI=1S/C12H16N4O4S/c1-16-11(12(17)20-15-16)8-14-7-6-9-2-4-10(5-3-9)21(13,18)19/h2-5,14H,6-8H2,1H3,(H2-,13,15,17,18,19) | C[n+]1c(c(on1)[O-])CNCCc2ccc(cc2)S(=O)(=O)N | |
| AKOS005252675 | 308.359 | C12 H16 N6 O2 S | UPSIIUSVZRUHIN-UHFFFAOYSA-N | InChI=1S/C12H16N6O2S/c1-8-5-9(2)14-12(13-8)21-7-10(19)15-11-6-18(16-20-11)17(3)4/h5-6H,7H2,1-4H3 | Cc1cc(nc(n1)SCC(=O)[N-]c2c[n+](no2)N(C)C)C | |
| AKOS005253048 | 340.424 | C12 H16 N6 O2 S2 | KBIZXNZTBNUHFE-UHFFFAOYSA-N | InChI=1S/C12H16N6O2S2/c1-9-14-15-12(22-9)21-8-10(19)13-11-7-18(16-20-11)17-5-3-2-4-6-17/h7H,2-6,8H2,1H3 | Cc1nnc(s1)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3 | |
| AKOS005252933 | 324.359 | C12 H16 N6 O3 S | CYVVMACCTCVTDQ-UHFFFAOYSA-N | InChI=1S/C12H16N6O3S/c1-16-3-2-13-12(16)22-9-10(19)14-11-8-18(15-21-11)17-4-6-20-7-5-17/h2-3,8H,4-7,9H2,1H3 | Cn1ccnc1SCC(=O)[N-]c2c[n+](no2)N3CCOCC3 | |
| AKOS005253162 | 336.373 | C12 H16 N8 O2 S | YOOVKKCXWJTSHH-UHFFFAOYSA-N | InChI=1S/C12H16N8O2S/c13-11-14-8-15-12(17-11)23-7-9(21)16-10-6-20(18-22-10)19-4-2-1-3-5-19/h6,8H,1-5,7H2,(H2-,13,14,15,16,17,18,21) | c1c(on[n+]1N2CCCCC2)[N-]C(=O)CSc3ncnc(n3)N | |
| AKOS005253025 | 352.372 | C12 H16 N8 O3 S | FXYQKENDSAQAQV-UHFFFAOYSA-N | InChI=1S/C12H16N8O3S/c13-8-5-9(14)16-12(15-8)24-7-10(21)17-11-6-20(18-23-11)19-1-3-22-4-2-19/h5-6H,1-4,7H2,(H4-,13,14,15,16,17,18,21) | c1c(nc(nc1N)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3)N | |
| AKOS005214890 | 251.282 | C12 H17 N3 O3 | QETWZAPTYVFYOR-UHFFFAOYSA-N | InChI=1S/C12H17N3O3/c1-8(16)11-12(13-9(2)17)18-14-15(11)10-6-4-3-5-7-10/h10H,3-7H2,1-2H3 | CC(=O)c1c(on[n+]1C2CCCCC2)[N-]C(=O)C | |
| AKOS005215665 | 251.282 | C12 H17 N3 O3 | GUBLAQQQZKAKOX-UHFFFAOYSA-N | InChI=1S/C12H17N3O3/c1-9(17)13-12-11(8-16)15(14-18-12)10-6-4-2-3-5-7-10/h8,10H,2-7H2,1H3 | CC(=O)[N-]c1c([n+](no1)C2CCCCCC2)C=O | |
| AKOS005219563 | 315.412 | C12 H17 N3 O3 S2 | QXKYNZNOGYXXIX-UHFFFAOYSA-N | InChI=1S/C12H17N3O3S2/c1-8-5-3-4-6-15(8)12(19)20-7-9(16)10-11(17)18-13-14(10)2/h8H,3-7H2,1-2H3 | CC1CCCCN1C(=S)SCC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005215547 | 267.281 | C12 H17 N3 O4 | AGJYDQODNMMSAY-UHFFFAOYSA-N | InChI=1S/C12H17N3O4/c1-2-18-12(17)11(16)13-10-8-15(14-19-10)9-6-4-3-5-7-9/h8-9H,2-7H2,1H3 | CCOC(=O)C(=O)[N-]c1c[n+](no1)C2CCCCC2 | |
| AKOS005253136 | 295.361 | C12 H17 N5 O2 S | PXWFDJLJTUIHOJ-UHFFFAOYSA-N | InChI=1S/C12H17N5O2S/c1-16(2)17-7-12(19-15-17)14-11(18)8-20-10-5-3-9(13)4-6-10/h3,5,7H,4,6,8,13H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=CC=C(CC2)N | |
| AKOS005253047 | 327.426 | C12 H17 N5 O2 S2 | PSQSCNYFLYFCRO-UHFFFAOYSA-N | InChI=1S/C12H17N5O2S2/c18-10(9-21-12-13-4-7-20-12)14-11-8-17(15-19-11)16-5-2-1-3-6-16/h8H,1-7,9H2 | c1c(on[n+]1N2CCCCC2)[N-]C(=O)CSC3=NCCS3 | |
| AKOS005214975 | 271.743 | C12 H18 Cl N3 O2 | RACJTMNRHSYALQ-UHFFFAOYSA-N | InChI=1S/C12H18ClN3O2/c1-9(17)14-12-11(8-13)16(15-18-12)10-6-4-2-3-5-7-10/h10H,2-8H2,1H3 | CC(=O)[N-]c1c([n+](no1)C2CCCCCC2)CCl | |
| AKOS005214947 | 282.296 | C12 H18 N4 O4 | DRTBDGIOQLSOJO-UHFFFAOYSA-N | InChI=1S/C12H18N4O4/c1-9(17)11-12(13-10(2)18)20-14-16(11)4-3-15-5-7-19-8-6-15/h3-8H2,1-2H3 | CC(=O)c1c(on[n+]1CCN2CCOCC2)[N-]C(=O)C | |
| AKOS005215661 | 282.296 | C12 H18 N4 O4 | XKDWMIUJQSVENX-UHFFFAOYSA-N | InChI=1S/C12H18N4O4/c1-8(17)13-12-10(11(18)9-2-3-9)16(14-20-12)15-4-6-19-7-5-15/h9,11,18H,2-7H2,1H3 | CC(=O)[N-]c1c([n+](no1)N2CCOCC2)C(C3CC3)O | |
| AKOS005219503 | 314.295 | C12 H18 N4 O6 | IRYQGBYBBLDEGG-UHFFFAOYSA-N | InChI=1S/C12H18N4O6/c1-12(2,3)20-11(18)22-13-10-9(8-17)16(14-21-10)15-4-6-19-7-5-15/h8H,4-7H2,1-3H3 | CC(C)(C)OC(=O)O[N-]c1c([n+](no1)N2CCOCC2)C=O | |
| AKOS005214240 | 237.298 | C12 H19 N3 O2 | UHVGKMYOJOTTNN-UHFFFAOYSA-N | InChI=1S/C12H19N3O2/c1-15-11(12(16)17-14-15)9-13-8-7-10-5-3-2-4-6-10/h5,13H,2-4,6-9H2,1H3 | C[n+]1c(c(on1)[O-])CNCCC2=CCCCC2 | |
| AKOS005252512 | 269.363 | C12 H19 N3 O2 S | UZLROXJSKAWNGL-UHFFFAOYSA-N | InChI=1S/C12H19N3O2S/c1-2-15-8-12(17-14-15)13-11(16)9-18-10-6-4-3-5-7-10/h8,10H,2-7,9H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSC2CCCCC2 | |
| AKOS005214924 | 253.298 | C12 H19 N3 O3 | UNGCOLJJDPMBGZ-UHFFFAOYSA-N | InChI=1S/C12H19N3O3/c1-9(17)13-12-11(8-16)15(14-18-12)10-6-4-2-3-5-7-10/h10,16H,2-8H2,1H3 | CC(=O)[N-]c1c([n+](no1)C2CCCCCC2)CO | |
| AKOS005215028 | 253.298 | C12 H19 N3 O3 | FPDKWUINHPYJJR-UHFFFAOYSA-N | InChI=1S/C12H19N3O3/c1-8(16)11-12(13-9(2)17)18-14-15(11)10-6-4-3-5-7-10/h8,10,16H,3-7H2,1-2H3 | CC(c1c(on[n+]1C2CCCCC2)[N-]C(=O)C)O | |
| AKOS005250355 | 253.298 | C12 H19 N3 O3 | HLATYGYMYGFVCZ-UHFFFAOYSA-N | InChI=1S/C12H19N3O3/c1-14(8-10-12(17)18-13-15(10)2)11(16)9-6-4-3-5-7-9/h9H,3-8H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)C2CCCCC2 | |
| AKOS005214945 | 252.313 | C12 H20 N4 O2 | YEHWYRBCENEHST-UHFFFAOYSA-N | InChI=1S/C12H20N4O2/c1-9(17)14-12-11(8-13-2)16(15-18-12)10-6-4-3-5-7-10/h10,13H,3-8H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)C2CCCCC2)CNC | |
| AKOS005215062 | 252.313 | C12 H20 N4 O2 | UQMCGLWUBLIASI-UHFFFAOYSA-N | InChI=1S/C12H20N4O2/c1-9(17)14-12-11(8-13)16(15-18-12)10-6-4-2-3-5-7-10/h10H,2-8,13H2,1H3 | CC(=O)[N-]c1c([n+](no1)C2CCCCCC2)CN | |
| AKOS005252676 | 284.378 | C12 H20 N4 O2 S | RQSQOMYMSNCTHG-UHFFFAOYSA-N | InChI=1S/C12H20N4O2S/c1-15(2)16-8-12(18-14-16)13-11(17)9-19-10-6-4-3-5-7-10/h8,10H,3-7,9H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2CCCCC2 | |
| AKOS005215579 | 268.312 | C12 H20 N4 O3 | WEWYALARALRWIK-UHFFFAOYSA-N | InChI=1S/C12H20N4O3/c1-12(2,3)18-11(17)13-10-9-16(14-19-10)15-7-5-4-6-8-15/h9H,4-8H2,1-3H3 | CC(C)(C)OC(=O)[N-]c1c[n+](no1)N2CCCCC2 | |
| AKOS005214858 | 284.312 | C12 H20 N4 O4 | CBECHJAMRHIFIF-UHFFFAOYSA-N | InChI=1S/C12H20N4O4/c1-9(17)11-12(13-10(2)18)20-14-16(11)4-3-15-5-7-19-8-6-15/h9,17H,3-8H2,1-2H3 | CC(c1c(on[n+]1CCN2CCOCC2)[N-]C(=O)C)O | |
| AKOS005214178 | 239.314 | C12 H21 N3 O2 | AOSKZERLDZUXTH-UHFFFAOYSA-N | InChI=1S/C12H21N3O2/c1-9(2)15-11(12(16)17-14-15)8-13-10-6-4-3-5-7-10/h9-10,13H,3-8H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNC2CCCCC2 | |
| AKOS005215600 | 271.379 | C12 H21 N3 O2 S | BZFVFPJRQFEYBG-UHFFFAOYSA-N | InChI=1S/C12H21N3O2S/c1-6-7-8-15-10(18-5)9(17-14-15)13-11(16)12(2,3)4/h6-8H2,1-5H3 | CCCC[n+]1c(c(on1)[N-]C(=O)C(C)(C)C)SC | |
| AKOS005214998 | 283.327 | C12 H21 N5 O3 | UVUKVQUHLZTFGD-UHFFFAOYSA-N | InChI=1S/C12H21N5O3/c1-10(18)14-12-11(9-13-2)17(15-20-12)4-3-16-5-7-19-8-6-16/h13H,3-9H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)CCN2CCOCC2)CNC | |
| AKOS005214257 | 270.328 | C12 H22 N4 O3 | CHUDKDQTJZCDPE-UHFFFAOYSA-N | InChI=1S/C12H22N4O3/c1-10(2)16-11(12(17)19-14-16)9-13-3-4-15-5-7-18-8-6-15/h10,13H,3-9H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCCN2CCOCC2 | |
| AKOS005251117 | 405.248 | C12 H6 F7 N3 O3 S | PKZULCBKSZKBQL-UHFFFAOYSA-N | InChI=1S/C12H6F7N3O3S/c1-22-10(11(24)25-21-22)26-2-3(23)20-9-7(15)5(13)4(12(17,18)19)6(14)8(9)16/h2H2,1H3,(H-,20,21,23,24) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2c(c(c(c(c2F)F)C(F)(F)F)F)F | |
| AKOS005219818 | 238.202 | C12 H6 N4 O2 | VDSKJGBSUHYOBD-UHFFFAOYSA-N | InChI=1S/C12H6N4O2/c13-7-9(8-14)6-11-12(17)18-15-16(11)10-4-2-1-3-5-10/h1-6H | c1ccc(cc1)[n+]2c(c(on2)[O-])C=C(C#N)C#N | |
| AKOS005251105 | 367.731 | C12 H9 Cl F3 N3 O3 S | WHSYLHONXOCOMG-UHFFFAOYSA-N | InChI=1S/C12H9ClF3N3O3S/c1-19-10(11(21)22-18-19)23-5-9(20)17-8-3-2-6(13)4-7(8)12(14,15)16/h2-4H,5H2,1H3,(H-,17,18,20,21) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2C(F)(F)F)Cl | |
| AKOS005251106 | 367.731 | C12 H9 Cl F3 N3 O3 S | HVGZQBDDTPOPLP-UHFFFAOYSA-N | InChI=1S/C12H9ClF3N3O3S/c1-19-10(11(21)22-18-19)23-5-9(20)17-8-4-6(12(14,15)16)2-3-7(8)13/h2-4H,5H2,1H3,(H-,17,18,20,21) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2cc(ccc2Cl)C(F)(F)F | |
| AKOS005215678 | 314.124 | C12 H9 Cl2 N3 O3 | UGMCJEVGKRDGSN-UHFFFAOYSA-N | InChI=1S/C12H9Cl2N3O3/c1-7(19)15-12-11(6-18)17(16-20-12)5-8-2-3-9(13)4-10(8)14/h2-4,6H,5H2,1H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2Cl)Cl)C=O | |
| AKOS005251457 | 351.277 | C12 H9 F4 N3 O3 S | ISJDNBYQAVDGHD-UHFFFAOYSA-N | InChI=1S/C12H9F4N3O3S/c1-4(23-11-12(21)22-18-19(11)2)10(20)17-9-7(15)5(13)3-6(14)8(9)16/h3-4H,1-2H3,(H-,17,18,20,21) | CC(C(=O)Nc1c(c(cc(c1F)F)F)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005252382 | 351.277 | C12 H9 F4 N3 O3 S | HABGRUWFUYMHTN-UHFFFAOYSA-N | InChI=1S/C12H9F4N3O3S/c1-19-11(12(21)22-18-19)23-3-2-7(20)17-10-8(15)5(13)4-6(14)9(10)16/h4H,2-3H2,1H3,(H-,17,18,20,21) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2c(c(cc(c2F)F)F)F | |
| AKOS005252625 | 295.745 | C12 H9 N3 O2 S . Cl H | VMLYJDLLFGNEFB-UHFFFAOYSA-N | InChI=1S/C12H9N3O2S.ClH/c1-8-13-10(7-18-8)11-12(16)17-14-15(11)9-5-3-2-4-6-9;/h2-7H,1H3;1H | Cc1nc(cs1)c2c(on[n+]2c3ccccc3)[O-].Cl | |
| AKOS005252624 | 307.348 | C12 H9 N3 O3 S2 | XVLXVRSWZJDHAO-UHFFFAOYSA-N | InChI=1S/C12H9N3O3S2/c1-17-8-4-2-7(3-5-8)15-10(11(16)18-14-15)9-6-20-12(19)13-9/h2-6H,1H3,(H-,13,14,16,19) | COc1ccc(cc1)[n+]2c(c(on2)[O-])c3csc(n3)S | |
| AKOS005219543 | 291.283 | C12 H9 N3 O4 S | XIIQCPXSUHSLCM-UHFFFAOYSA-N | InChI=1S/C12H9N3O4S/c1-15-10(11(17)19-14-15)8(16)6-20-12-13-7-4-2-3-5-9(7)18-12/h2-5H,6H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2nc3ccccc3o2 | |
| AKOS005250797 | 335.362 | C12 H9 N5 O3 S2 | UPXIJETVTGHSIY-UHFFFAOYSA-N | InChI=1S/C12H9N5O3S2/c13-11-14-15-12(22-11)21-6-8(18)9-10(19)20-16-17(9)7-4-2-1-3-5-7/h1-5H,6H2,(H2-,13,14,16,18,19) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nnc(s3)N | |
| AKOS005252520 | 357.311 | C13 H10 F3 N5 O2 S | ZYVSAAFGABHAKK-UHFFFAOYSA-N | InChI=1S/C13H10F3N5O2S/c1-7-3-9(13(14,15)16)8(4-17)12(18-7)24-6-10(22)19-11-5-21(2)20-23-11/h3,5H,6H2,1-2H3 | Cc1cc(c(c(n1)SCC(=O)[N-]c2c[n+](no2)C)C#N)C(F)(F)F | |
| AKOS005252521 | 357.311 | C13 H10 F3 N5 O2 S | YHJHCNHIFXXUDE-UHFFFAOYSA-N | InChI=1S/C13H10F3N5O2S/c1-7-3-9(13(14,15)16)18-12(8(7)4-17)24-6-10(22)19-11-5-21(2)20-23-11/h3,5H,6H2,1-2H3 | Cc1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)C)C(F)(F)F | |
| AKOS005250586 | 270.244 | C13 H10 N4 O3 | PGYTVZPDEIHABW-UHFFFAOYSA-N | InChI=1S/C13H10N4O3/c1-17-11(13(19)20-16-17)12(18)15-10-6-2-5-9-8(10)4-3-7-14-9/h2-7H,1H3,(H-,14,15,16,18,19) | C[n+]1c(c(on1)[O-])C(=O)Nc2cccc3c2cccn3 | |
| AKOS005219880 | 302.308 | C13 H10 N4 O3 S | DLPRRAPVQBTVAU-UHFFFAOYSA-O | InChI=1S/C13H9N4O3S/c1-16-10(12(19)20-15-16)7-9-11(18)17(13(21)14-9)8-5-3-2-4-6-8/h2-7H,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C\2/C(=O)N(C(=N2)S)c3ccccc3 | |
| AKOS005219517 | 334.374 | C13 H10 N4 O3 S2 | CHXSGWMDEZXIHL-UHFFFAOYSA-N | InChI=1S/C13H10N4O3S2/c1-8-14-15-13(22-8)21-7-10(18)11-12(19)20-16-17(11)9-5-3-2-4-6-9/h2-6H,7H2,1H3 | Cc1nnc(s1)SCC(=O)c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250786 | 330.322 | C13 H10 N6 O3 S | KUFPHQGBKCFHQB-UHFFFAOYSA-N | InChI=1S/C13H10N6O3S/c14-12-15-7-16-13(17-12)23-6-9(20)10-11(21)22-18-19(10)8-4-2-1-3-5-8/h1-5,7H,6H2,(H2-,14,15,16,17,18,20,21) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3ncnc(n3)N | |
| AKOS005251435 | 381.758 | C13 H11 Cl F3 N3 O3 S | UGHBVXXMQUOHIP-UHFFFAOYSA-N | InChI=1S/C13H11ClF3N3O3S/c1-6(24-11-12(22)23-19-20(11)2)10(21)18-9-4-3-7(14)5-8(9)13(15,16)17/h3-6H,1-2H3,(H-,18,19,21,22) | CC(C(=O)Nc1ccc(cc1C(F)(F)F)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005251443 | 381.758 | C13 H11 Cl F3 N3 O3 S | GUPBKNABAZVKKB-UHFFFAOYSA-N | InChI=1S/C13H11ClF3N3O3S/c1-6(24-11-12(22)23-19-20(11)2)10(21)18-9-5-7(13(15,16)17)3-4-8(9)14/h3-6H,1-2H3,(H-,18,19,21,22) | CC(C(=O)Nc1cc(ccc1Cl)C(F)(F)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005252350 | 381.758 | C13 H11 Cl F3 N3 O3 S | ZNNOEMNCQQLDCD-UHFFFAOYSA-N | InChI=1S/C13H11ClF3N3O3S/c1-20-11(12(22)23-19-20)24-5-4-10(21)18-9-3-2-7(14)6-8(9)13(15,16)17/h2-3,6H,4-5H2,1H3,(H-,18,19,21,22) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2C(F)(F)F)Cl | |
| AKOS005252358 | 381.758 | C13 H11 Cl F3 N3 O3 S | GKQNNPOETZHLMV-UHFFFAOYSA-N | InChI=1S/C13H11ClF3N3O3S/c1-20-11(12(22)23-19-20)24-5-4-10(21)18-9-6-7(13(15,16)17)2-3-8(9)14/h2-3,6H,4-5H2,1H3,(H-,18,19,21,22) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cc(ccc2Cl)C(F)(F)F | |
| AKOS005214905 | 328.151 | C13 H11 Cl2 N3 O3 | CHEJAGDAVBCXNX-UHFFFAOYSA-N | InChI=1S/C13H11Cl2N3O3/c1-7(19)12-13(16-8(2)20)21-17-18(12)6-9-3-4-10(14)5-11(9)15/h3-5H,6H2,1-2H3 | CC(=O)c1c(on[n+]1Cc2ccc(cc2Cl)Cl)[N-]C(=O)C | |
| AKOS005251897 | 365.303 | C13 H11 F4 N3 O3 S | XLQXRMVLYNGTTB-UHFFFAOYSA-N | InChI=1S/C13H11F4N3O3S/c1-3-7(24-12-13(22)23-19-20(12)2)11(21)18-10-8(16)5(14)4-6(15)9(10)17/h4,7H,3H2,1-2H3,(H-,18,19,21,22) | CCC(C(=O)Nc1c(c(cc(c1F)F)F)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005252617 | 325.771 | C13 H11 N3 O3 S . Cl H | CTBSREKUYKRXAV-UHFFFAOYSA-N | InChI=1S/C13H11N3O3S.ClH/c1-8-14-11(7-20-8)12-13(17)19-15-16(12)9-3-5-10(18-2)6-4-9;/h3-7H,1-2H3;1H | Cc1nc(cs1)c2c(on[n+]2c3ccc(cc3)OC)[O-].Cl | |
| AKOS005219516 | 321.375 | C13 H11 N3 O3 S2 | KMEUBEDFGZYVGY-UHFFFAOYSA-N | InChI=1S/C13H11N3O3S2/c17-10(8-21-13-14-6-7-20-13)11-12(18)19-15-16(11)9-4-2-1-3-5-9/h1-5H,6-8H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=NCCS3 | |
| AKOS005250427 | 365.388 | C13 H11 N5 O4 S2 | XDIHTLHTCKDTFV-UHFFFAOYSA-N | InChI=1S/C13H11N5O4S2/c1-21-8-4-2-7(3-5-8)18-10(11(20)22-17-18)9(19)6-23-13-16-15-12(14)24-13/h2-5H,6H2,1H3,(H2-,14,15,17,19,20) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nnc(s3)N | |
| AKOS005214922 | 293.706 | C13 H12 Cl N3 O3 | HMSBHTNWPVKFHL-UHFFFAOYSA-N | InChI=1S/C13H12ClN3O3/c1-8(18)12-13(15-9(2)19)20-16-17(12)7-10-5-3-4-6-11(10)14/h3-6H,7H2,1-2H3 | CC(=O)c1c(on[n+]1Cc2ccccc2Cl)[N-]C(=O)C | |
| AKOS005251428 | 357.769 | C13 H12 Cl N3 O5 S | SJSZPSJUUFIPQF-UHFFFAOYSA-N | InChI=1S/C13H12ClN3O5S/c1-6(23-11-13(21)22-16-17(11)2)10(18)15-7-3-4-9(14)8(5-7)12(19)20/h3-6H,1-2H3,(H2-,15,16,18,19,20,21) | CC(C(=O)Nc1ccc(c(c1)C(=O)O)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005251436 | 357.769 | C13 H12 Cl N3 O5 S | CJRKJRAUHPUNSW-UHFFFAOYSA-N | InChI=1S/C13H12ClN3O5S/c1-6(23-11-13(21)22-16-17(11)2)10(18)15-9-5-7(12(19)20)3-4-8(9)14/h3-6H,1-2H3,(H2-,15,16,18,19,20,21) | CC(C(=O)Nc1cc(ccc1Cl)C(=O)O)Sc2c(on[n+]2C)[O-] | |
| AKOS005252353 | 357.769 | C13 H12 Cl N3 O5 S | IOOPRMTUJBMHPA-UHFFFAOYSA-N | InChI=1S/C13H12ClN3O5S/c1-17-11(13(21)22-16-17)23-5-4-10(18)15-7-2-3-9(14)8(6-7)12(19)20/h2-3,6H,4-5H2,1H3,(H2-,15,16,18,19,20,21) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(c(c2)C(=O)O)Cl | |
| AKOS005252361 | 357.769 | C13 H12 Cl N3 O5 S | CJOGFQSJEFFPSQ-UHFFFAOYSA-N | InChI=1S/C13H12ClN3O5S/c1-17-11(13(21)22-16-17)23-5-4-10(18)15-9-6-7(12(19)20)2-3-8(9)14/h2-3,6H,4-5H2,1H3,(H2-,15,16,18,19,20,21) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cc(ccc2Cl)C(=O)O | |
| AKOS005214906 | 277.251 | C13 H12 F N3 O3 | FJPIORDSRQTWQK-UHFFFAOYSA-N | InChI=1S/C13H12FN3O3/c1-8(18)12-13(15-9(2)19)20-16-17(12)7-10-3-5-11(14)6-4-10/h3-6H,7H2,1-2H3 | CC(=O)c1c(on[n+]1Cc2ccc(cc2)F)[N-]C(=O)C | |
| AKOS005251393 | 347.313 | C13 H12 F3 N3 O3 S | FBJHYDXQJJCUJN-UHFFFAOYSA-N | InChI=1S/C13H12F3N3O3S/c1-7(23-11-12(21)22-18-19(11)2)10(20)17-9-6-4-3-5-8(9)13(14,15)16/h3-7H,1-2H3,(H-,17,18,20,21) | CC(C(=O)Nc1ccccc1C(F)(F)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005251394 | 347.313 | C13 H12 F3 N3 O3 S | YRMKPDNRKKSYNR-UHFFFAOYSA-N | InChI=1S/C13H12F3N3O3S/c1-7(23-11-12(21)22-18-19(11)2)10(20)17-9-5-3-4-8(6-9)13(14,15)16/h3-7H,1-2H3,(H-,17,18,20,21) | CC(C(=O)Nc1cccc(c1)C(F)(F)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005252282 | 347.313 | C13 H12 F3 N3 O3 S | MZMNZSPBWWRZAZ-UHFFFAOYSA-N | InChI=1S/C13H12F3N3O3S/c1-19-11(12(21)22-18-19)23-7-6-10(20)17-9-5-3-2-4-8(9)13(14,15)16/h2-5H,6-7H2,1H3,(H-,17,18,20,21) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccccc2C(F)(F)F | |
| AKOS005252283 | 347.313 | C13 H12 F3 N3 O3 S | RKNUCRIVVPVECV-UHFFFAOYSA-N | InChI=1S/C13H12F3N3O3S/c1-19-11(12(21)22-18-19)23-6-5-10(20)17-9-4-2-3-8(7-9)13(14,15)16/h2-4,7H,5-6H2,1H3,(H-,17,18,20,21) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cccc(c2)C(F)(F)F | |
| AKOS005250335 | 331.247 | C13 H12 F3 N3 O4 | QHZRIWNNFJYKTN-UHFFFAOYSA-N | InChI=1S/C13H12F3N3O4/c1-18(12(21)13(14,15)16)7-10-11(20)23-17-19(10)8-3-5-9(22-2)6-4-8/h3-6H,7H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)C(F)(F)F | |
| AKOS005251495 | 363.312 | C13 H12 F3 N3 O4 S | WGGFGVCFVRVWGV-UHFFFAOYSA-N | InChI=1S/C13H12F3N3O4S/c1-7(24-11-12(21)23-18-19(11)2)10(20)17-8-3-5-9(6-4-8)22-13(14,15)16/h3-7H,1-2H3,(H-,17,18,20,21) | CC(C(=O)Nc1ccc(cc1)OC(F)(F)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005251496 | 363.312 | C13 H12 F3 N3 O4 S | LJQYFZFYKAKQES-UHFFFAOYSA-N | InChI=1S/C13H12F3N3O4S/c1-7(24-11-12(21)23-18-19(11)2)10(20)17-8-5-3-4-6-9(8)22-13(14,15)16/h3-7H,1-2H3,(H-,17,18,20,21) | CC(C(=O)Nc1ccccc1OC(F)(F)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005252332 | 363.312 | C13 H12 F3 N3 O4 S | QAPNIBOJSKHWTP-UHFFFAOYSA-N | InChI=1S/C13H12F3N3O4S/c1-19-11(12(21)23-18-19)24-7-6-10(20)17-8-2-4-9(5-3-8)22-13(14,15)16/h2-5H,6-7H2,1H3,(H-,17,18,20,21) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2)OC(F)(F)F | |
| AKOS005252333 | 363.312 | C13 H12 F3 N3 O4 S | WKRISDVCDSQUPQ-UHFFFAOYSA-N | InChI=1S/C13H12F3N3O4S/c1-19-11(12(21)23-18-19)24-7-6-10(20)17-8-4-2-3-5-9(8)22-13(14,15)16/h2-5H,6-7H2,1H3,(H-,17,18,20,21) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccccc2OC(F)(F)F | |
| AKOS005219540 | 304.324 | C13 H12 N4 O3 S | JTWZWGMAQYPFBS-UHFFFAOYSA-N | InChI=1S/C13H12N4O3S/c1-7-4-8(2)15-12(9(7)5-14)21-6-10(18)11-13(19)20-16-17(11)3/h4H,6H2,1-3H3 | Cc1cc(nc(c1C#N)SCC(=O)c2c(on[n+]2C)[O-])C | |
| AKOS005219735 | 304.324 | C13 H12 N4 O3 S | AJMIFHDAUPIQAH-UHFFFAOYSA-O | InChI=1S/C13H10N4O3S/c1-16-10(12(19)20-15-16)7-9-11(18)17(13(21)14-9)8-5-3-2-4-6-8/h2-7H,1H3,(H,18,21)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C\2/C(=O)N(=C(N2)S)c3ccccc3 | |
| AKOS005250597 | 304.324 | C13 H12 N4 O3 S | ANPUKWCRKYENAJ-UHFFFAOYSA-N | InChI=1S/C13H12N4O3S/c1-17-10(13(19)20-16-17)11(18)15-12-8(6-14)7-4-2-3-5-9(7)21-12/h2-5H2,1H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])C(=O)Nc2c(c3c(s2)CCCC3)C#N | |
| AKOS005251129 | 304.324 | C13 H12 N4 O3 S | QUVJNLIUYZSYSE-UHFFFAOYSA-N | InChI=1S/C13H12N4O3S/c1-17-12(13(19)20-16-17)21-7-11(18)15-9-2-3-10-8(6-9)4-5-14-10/h2-6,16,19H,7H2,1H3 | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc3c(c2)cc[nH]3 | |
| AKOS005252488 | 304.324 | C13 H12 N4 O3 S | STZREGACSGNDOA-UHFFFAOYSA-N | InChI=1S/C13H12N4O3S/c1-2-17-7-12(20-16-17)15-11(18)8-21-13-14-9-5-3-4-6-10(9)19-13/h3-7H,2,8H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3o2 | |
| AKOS005253879 | 304.324 | C13 H12 N4 O3 S | NCHHGWOMFXZFCT-UHFFFAOYSA-N | InChI=1S/C13H12N4O3S/c1-5-4-6(2)15-12-7(5)8(14)11(21-12)10(18)9-13(19)20-16-17(9)3/h4H,1-3H3,(H2-,14,16,18,19) | Cc1cc(nc2c1c(c(s2)C(=O)c3c(on[n+]3C)[O-])N)C | |
| AKOS005253880 | 304.324 | C13 H12 N4 O3 S | RYRYSSQEMYBPCO-UHFFFAOYSA-N | InChI=1S/C13H12N4O3S/c1-5-4-7-8(14)11(21-12(7)15-6(5)2)10(18)9-13(19)20-16-17(9)3/h4H,1-3H3,(H2-,14,16,18,19) | Cc1cc2c(c(sc2nc1C)C(=O)c3c(on[n+]3C)[O-])N | |
| AKOS005251676 | 390.228 | C13 H13 Br F N3 O3 S | GFLXIXZDFGGTNM-UHFFFAOYSA-N | InChI=1S/C13H13BrFN3O3S/c1-3-10(22-12-13(20)21-17-18(12)2)11(19)16-9-5-4-7(14)6-8(9)15/h4-6,10H,3H2,1-2H3,(H-,16,17,19,20) | CCC(C(=O)Nc1ccc(cc1F)Br)Sc2c(on[n+]2C)[O-] | |
| AKOS005251731 | 345.777 | C13 H13 Cl F N3 O3 S | YYMOPHPFTQLXHG-UHFFFAOYSA-N | InChI=1S/C13H13ClFN3O3S/c1-3-10(22-12-13(20)21-17-18(12)2)11(19)16-7-4-5-9(15)8(14)6-7/h4-6,10H,3H2,1-2H3,(H-,16,17,19,20) | CCC(C(=O)Nc1ccc(c(c1)Cl)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005215044 | 330.167 | C13 H13 Cl2 N3 O3 | NMDDYKUWYUZHDL-UHFFFAOYSA-N | InChI=1S/C13H13Cl2N3O3/c1-7(19)12-13(16-8(2)20)21-17-18(12)6-9-3-4-10(14)5-11(9)15/h3-5,7,19H,6H2,1-2H3 | CC(c1c(on[n+]1Cc2ccc(cc2Cl)Cl)[N-]C(=O)C)O | |
| AKOS005252015 | 362.232 | C13 H13 Cl2 N3 O3 S | VCBLSEBAGWCQIK-UHFFFAOYSA-N | InChI=1S/C13H13Cl2N3O3S/c1-3-10(22-12-13(20)21-17-18(12)2)11(19)16-9-5-7(14)4-8(15)6-9/h4-6,10H,3H2,1-2H3,(H-,16,17,19,20) | CCC(C(=O)Nc1cc(cc(c1)Cl)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005252117 | 362.232 | C13 H13 Cl2 N3 O3 S | JUXFNKSFDYCSMV-UHFFFAOYSA-N | InChI=1S/C13H13Cl2N3O3S/c1-3-10(22-12-13(20)21-17-18(12)2)11(19)16-9-6-7(14)4-5-8(9)15/h4-6,10H,3H2,1-2H3,(H-,16,17,19,20) | CCC(C(=O)Nc1cc(ccc1Cl)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005252126 | 362.232 | C13 H13 Cl2 N3 O3 S | NIWZXCLTBRJHOL-UHFFFAOYSA-N | InChI=1S/C13H13Cl2N3O3S/c1-3-10(22-12-13(20)21-17-18(12)2)11(19)16-7-4-5-8(14)9(15)6-7/h4-6,10H,3H2,1-2H3,(H-,16,17,19,20) | CCC(C(=O)Nc1ccc(c(c1)Cl)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005252131 | 362.232 | C13 H13 Cl2 N3 O3 S | ZESWQJCKTYXJHS-UHFFFAOYSA-N | InChI=1S/C13H13Cl2N3O3S/c1-3-9(22-12-13(20)21-17-18(12)2)11(19)16-8-6-4-5-7(14)10(8)15/h4-6,9H,3H2,1-2H3,(H-,16,17,19,20) | CCC(C(=O)Nc1cccc(c1Cl)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005252140 | 362.232 | C13 H13 Cl2 N3 O3 S | AKQODZHOEFSXHU-UHFFFAOYSA-N | InChI=1S/C13H13Cl2N3O3S/c1-3-10(22-12-13(20)21-17-18(12)2)11(19)16-9-5-4-7(14)6-8(9)15/h4-6,10H,3H2,1-2H3,(H-,16,17,19,20) | CCC(C(=O)Nc1ccc(cc1Cl)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005251988 | 329.322 | C13 H13 F2 N3 O3 S | REVZTAJSJMPTAG-UHFFFAOYSA-N | InChI=1S/C13H13F2N3O3S/c1-3-10(22-12-13(20)21-17-18(12)2)11(19)16-7-4-5-8(14)9(15)6-7/h4-6,10H,3H2,1-2H3,(H-,16,17,19,20) | CCC(C(=O)Nc1ccc(c(c1)F)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005214891 | 259.261 | C13 H13 N3 O3 | WMULXHKMXFZNPY-UHFFFAOYSA-N | InChI=1S/C13H13N3O3/c1-9(17)12-13(14-10(2)18)19-15-16(12)8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3 | CC(=O)c1c(on[n+]1Cc2ccccc2)[N-]C(=O)C | |
| AKOS005215569 | 259.261 | C13 H13 N3 O3 | RQHHPPAADWZETL-UHFFFAOYSA-N | InChI=1S/C13H13N3O3/c1-9(2)16-11(8-17)13(19-15-16)14-12(18)10-6-4-3-5-7-10/h3-9H,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)C=O | |
| AKOS005215680 | 259.261 | C13 H13 N3 O3 | QAARNILFCBTSJL-UHFFFAOYSA-N | InChI=1S/C13H13N3O3/c1-9-3-5-11(6-4-9)7-16-12(8-17)13(19-15-16)14-10(2)18/h3-6,8H,7H2,1-2H3 | Cc1ccc(cc1)C[n+]2c(c(on2)[N-]C(=O)C)C=O | |
| AKOS005215693 | 259.261 | C13 H13 N3 O3 | HZAKITUTOZMLCI-UHFFFAOYSA-N | InChI=1S/C13H13N3O3/c1-10(18)14-13-12(9-17)16(15-19-13)8-7-11-5-3-2-4-6-11/h2-6,9H,7-8H2,1H3 | CC(=O)[N-]c1c([n+](no1)CCc2ccccc2)C=O | |
| AKOS005250498 | 259.261 | C13 H13 N3 O3 | KKEPVOXYUUITLM-UHFFFAOYSA-N | InChI=1S/C13H13N3O3/c17-12(15-8-4-5-9-15)11-13(18)19-14-16(11)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCCC3 | |
| AKOS005250389 | 291.326 | C13 H13 N3 O3 S | CEMNMSQRDFGHFK-UHFFFAOYSA-N | InChI=1S/C13H13N3O3S/c17-12(15-6-8-20-9-7-15)11-13(18)19-14-16(11)10-4-2-1-3-5-10/h1-5H,6-9H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCSCC3 | |
| AKOS005215691 | 275.26 | C13 H13 N3 O4 | MZKBAEZDDSSISO-UHFFFAOYSA-N | InChI=1S/C13H13N3O4/c1-9(18)14-13-12(8-17)16(15-20-13)7-10-3-5-11(19-2)6-4-10/h3-6,8H,7H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2)OC)C=O | |
| AKOS005250140 | 275.26 | C13 H13 N3 O4 | RZLINMUXLLYTEW-UHFFFAOYSA-N | InChI=1S/C13H13N3O4/c1-19-10-6-4-9(5-7-10)16-11(13(18)20-15-16)12(17)14-8-2-3-8/h4-8H,2-3H2,1H3,(H-,14,15,17,18) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NC3CC3 | |
| AKOS005250214 | 275.26 | C13 H13 N3 O4 | FBDMQGZPNPEIRH-UHFFFAOYSA-N | InChI=1S/C13H13N3O4/c1-3-8-14-12(17)11-13(18)20-15-16(11)9-4-6-10(19-2)7-5-9/h3-7H,1,8H2,2H3,(H-,14,15,17,18) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCC=C | |
| AKOS005250499 | 275.26 | C13 H13 N3 O4 | ONGPDUHSSQIXLN-UHFFFAOYSA-N | InChI=1S/C13H13N3O4/c17-12(15-6-8-19-9-7-15)11-13(18)20-14-16(11)10-4-2-1-3-5-10/h1-5H,6-9H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCOCC3 | |
| AKOS005251222 | 307.325 | C13 H13 N3 O4 S | VHITYYCEBGPVOM-UHFFFAOYSA-N | InChI=1S/C13H13N3O4S/c1-8(17)9-3-5-10(6-4-9)14-11(18)7-21-12-13(19)20-15-16(12)2/h3-6H,7H2,1-2H3,(H-,14,15,17,18,19) | CC(=O)c1ccc(cc1)NC(=O)CSc2c(on[n+]2C)[O-] | |
| AKOS005250515 | 291.259 | C13 H13 N3 O5 | QJPAVIVTWDXMRG-UHFFFAOYSA-N | InChI=1S/C13H13N3O5/c1-3-20-12(18)8-4-6-9(7-5-8)14-11(17)10-13(19)21-15-16(10)2/h4-7H,3H2,1-2H3,(H-,14,15,17,18,19) | CCOC(=O)c1ccc(cc1)NC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005219714 | 323.324 | C13 H13 N3 O5 S | LXGMPLFENQVGIV-UHFFFAOYSA-N | InChI=1S/C13H13N3O5S/c1-20-8-4-2-7(3-5-8)16-10(13(19)21-15-16)11-14-6-9(22-11)12(17)18/h2-5,9,11,14H,6H2,1H3,(H-,15,17,18,19) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C3NCC(S3)C(=O)O | |
| AKOS005251120 | 323.324 | C13 H13 N3 O5 S | ADQWMHKCHOPXAS-UHFFFAOYSA-N | InChI=1S/C13H13N3O5S/c1-7-3-4-8(12(18)19)5-9(7)14-10(17)6-22-11-13(20)21-15-16(11)2/h3-5H,6H2,1-2H3,(H2-,14,15,17,18,19,20) | Cc1ccc(cc1NC(=O)CSc2c(on[n+]2C)[O-])C(=O)O | |
| AKOS005251124 | 323.324 | C13 H13 N3 O5 S | PUFUVPNRFAUGRE-UHFFFAOYSA-N | InChI=1S/C13H13N3O5S/c1-16-12(13(18)21-15-16)22-7-11(17)14-8-2-3-9-10(6-8)20-5-4-19-9/h2-3,6H,4-5,7H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc3c(c2)OCCO3 | |
| AKOS005251237 | 323.324 | C13 H13 N3 O5 S | VXBGTDHPVSKJEN-UHFFFAOYSA-N | InChI=1S/C13H13N3O5S/c1-16-11(13(19)21-15-16)22-7-10(17)14-9-6-4-3-5-8(9)12(18)20-2/h3-6H,7H2,1-2H3,(H-,14,15,17,18,19) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccccc2C(=O)OC | |
| AKOS005251437 | 323.324 | C13 H13 N3 O5 S | LMQBRMHUWGOYRT-UHFFFAOYSA-N | InChI=1S/C13H13N3O5S/c1-7(22-11-13(20)21-15-16(11)2)10(17)14-9-5-3-8(4-6-9)12(18)19/h3-7H,1-2H3,(H2-,14,15,17,18,19,20) | CC(C(=O)Nc1ccc(cc1)C(=O)O)Sc2c(on[n+]2C)[O-] | |
| AKOS005251438 | 323.324 | C13 H13 N3 O5 S | WEDQNITTWAXFJL-UHFFFAOYSA-N | InChI=1S/C13H13N3O5S/c1-7(22-11-13(20)21-15-16(11)2)10(17)14-9-5-3-4-8(6-9)12(18)19/h3-7H,1-2H3,(H2-,14,15,17,18,19,20) | CC(C(=O)Nc1cccc(c1)C(=O)O)Sc2c(on[n+]2C)[O-] | |
| AKOS005251487 | 323.324 | C13 H13 N3 O5 S | LWLBTNCXYCLOCY-UHFFFAOYSA-N | InChI=1S/C13H13N3O5S/c1-7(22-12-13(18)21-15-16(12)2)11(17)14-8-3-4-9-10(5-8)20-6-19-9/h3-5,7H,6H2,1-2H3,(H-,14,15,17,18) | CC(C(=O)Nc1ccc2c(c1)OCO2)Sc3c(on[n+]3C)[O-] | |
| AKOS005252323 | 323.324 | C13 H13 N3 O5 S | XRAVEMPINHRJIG-UHFFFAOYSA-N | InChI=1S/C13H13N3O5S/c1-16-12(13(18)21-15-16)22-5-4-11(17)14-8-2-3-9-10(6-8)20-7-19-9/h2-3,6H,4-5,7H2,1H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc3c(c2)OCO3 | |
| AKOS005252362 | 323.324 | C13 H13 N3 O5 S | NALGHPOCAIHTSE-UHFFFAOYSA-N | InChI=1S/C13H13N3O5S/c1-16-11(13(20)21-15-16)22-7-6-10(17)14-9-4-2-8(3-5-9)12(18)19/h2-5H,6-7H2,1H3,(H2-,14,15,17,18,19,20) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2)C(=O)O | |
| AKOS005252363 | 323.324 | C13 H13 N3 O5 S | SKNONAIDBCYBQY-UHFFFAOYSA-N | InChI=1S/C13H13N3O5S/c1-16-11(13(20)21-15-16)22-6-5-10(17)14-9-4-2-3-8(7-9)12(18)19/h2-4,7H,5-6H2,1H3,(H2-,14,15,17,18,19,20) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cccc(c2)C(=O)O | |
| AKOS005251131 | 339.324 | C13 H13 N3 O6 S | IGUSLRWIECPFNF-UHFFFAOYSA-N | InChI=1S/C13H13N3O6S/c1-16-11(13(20)22-15-16)23-6-10(17)14-8-4-3-7(12(18)19)5-9(8)21-2/h3-5H,6H2,1-2H3,(H2-,14,15,17,18,19,20) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2OC)C(=O)O | |
| AKOS005251476 | 339.324 | C13 H13 N3 O6 S | CGAZJYRWJTUPBD-UHFFFAOYSA-N | InChI=1S/C13H13N3O6S/c1-6(23-11-13(21)22-15-16(11)2)10(18)14-7-3-4-9(17)8(5-7)12(19)20/h3-6,15H,1-2H3,(H2,19,20,21) | CC(C(=O)Nc1ccc(c(c1)C(=O)O)O)Sc2c(on[n+]2C)[O-] | |
| AKOS005252311 | 339.324 | C13 H13 N3 O6 S | UTFLQRMSDWMCBZ-UHFFFAOYSA-N | InChI=1S/C13H13N3O6S/c1-16-11(13(21)22-15-16)23-5-4-10(18)14-7-2-3-9(17)8(6-7)12(19)20/h2-3,6,15H,4-5H2,1H3,(H2,19,20,21) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(c(c2)C(=O)O)O | |
| AKOS005252021 | 337.331 | C13 H13 N4 O5 S | UCVLQNOEDKEMPH-UHFFFAOYSA-M | InChI=1S/C13H14N4O5S/c1-3-10(23-12-13(19)22-15-16(12)2)11(18)14-8-4-6-9(7-5-8)17(20)21/h4,6-7,10,19H,3H2,1-2H3,(H,14,18)/p-1 | CCC(C(=O)Nc1ccc(c[c-]1)[N+](=O)[O-])Sc2c(on[n+]2C)[O-] | |
| AKOS005219553 | 303.34 | C13 H13 N5 O2 S | LKXHXLHPHMDEMA-UHFFFAOYSA-N | InChI=1S/C13H13N5O2S/c1-3-18-7-12(20-17-18)16-11(19)8-21-13-10(6-14)5-4-9(2)15-13/h4-5,7H,3,8H2,1-2H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)C)C#N | |
| AKOS005252404 | 303.34 | C13 H13 N5 O2 S | PPKWIXKKBBBRFR-UHFFFAOYSA-N | InChI=1S/C13H13N5O2S/c1-8-4-9(2)15-13(10(8)5-14)21-7-11(19)16-12-6-18(3)17-20-12/h4,6H,7H2,1-3H3 | Cc1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)C)C | |
| AKOS005252496 | 303.34 | C13 H13 N5 O2 S | ZFIINSOLBBLMGK-UHFFFAOYSA-N | InChI=1S/C13H13N5O2S/c1-2-18-7-12(20-17-18)16-11(19)8-21-13-14-9-5-3-4-6-10(9)15-13/h3-7H,2,8H2,1H3,(H-,14,15,16,17,19) | CC[n+]1cc(on1)[N-]C(=O)CSc2[nH]c3ccccc3n2 | |
| AKOS005252787 | 319.339 | C13 H13 N5 O3 S | DLRLNIVDJLJFRY-UHFFFAOYSA-N | InChI=1S/C13H13N5O3S/c1-17(2)18-7-12(21-16-18)15-11(19)8-22-13-14-9-5-3-4-6-10(9)20-13/h3-7H,8H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3o2 | |
| AKOS005252437 | 331.353 | C13 H13 N7 O2 S | WJBKYRPFHVOBSL-UHFFFAOYSA-N | InChI=1S/C13H13N7O2S/c1-2-19-8-12(22-18-19)14-11(21)9-23-13-15-16-17-20(13)10-6-4-3-5-7-10/h3-8H,2,9H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2nnnn2c3ccccc3 | |
| AKOS000492147 | 324.173 | C13 H14 Br N3 O2 | LRPTWDWMPKCMIA-UHFFFAOYSA-N | InChI=1S/C13H14BrN3O2/c1-2-3-8-17-9-12(19-16-17)15-13(18)10-6-4-5-7-11(10)14/h4-7,9H,2-3,8H2,1H3 | CCCC[n+]1cc(on1)[N-]C(=O)c2ccccc2Br | MFCD03306025 |
| AKOS005215603 | 324.173 | C13 H14 Br N3 O2 | QFOYYIOMMJWULU-UHFFFAOYSA-N | InChI=1S/C13H14BrN3O2/c1-9(2)17-8-11(19-16-17)15-13(18)12(14)10-6-4-3-5-7-10/h3-9,12H,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)C(c2ccccc2)Br | |
| AKOS005251723 | 372.238 | C13 H14 Br N3 O3 S | QJNVJMAVICNZBN-UHFFFAOYSA-N | InChI=1S/C13H14BrN3O3S/c1-3-10(21-12-13(19)20-16-17(12)2)11(18)15-9-7-5-4-6-8(9)14/h4-7,10H,3H2,1-2H3,(H-,15,16,18,19) | CCC(C(=O)Nc1ccccc1Br)Sc2c(on[n+]2C)[O-] | |
| AKOS005251730 | 372.238 | C13 H14 Br N3 O3 S | YIXNMIWEFQAFSK-UHFFFAOYSA-N | InChI=1S/C13H14BrN3O3S/c1-3-10(21-12-13(19)20-16-17(12)2)11(18)15-9-6-4-8(14)5-7-9/h4-7,10H,3H2,1-2H3,(H-,15,16,18,19) | CCC(C(=O)Nc1ccc(cc1)Br)Sc2c(on[n+]2C)[O-] | |
| AKOS005214990 | 279.722 | C13 H14 Cl N3 O2 | VPTRSAQDHHLGQY-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O2/c1-9-3-5-11(6-4-9)8-17-12(7-14)13(19-16-17)15-10(2)18/h3-6H,7-8H2,1-2H3 | Cc1ccc(cc1)C[n+]2c(c(on2)[N-]C(=O)C)CCl | |
| AKOS005215004 | 279.722 | C13 H14 Cl N3 O2 | BXIWZAQNTUHEEZ-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O2/c1-10(18)15-13-12(9-14)17(16-19-13)8-7-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3 | CC(=O)[N-]c1c([n+](no1)CCc2ccccc2)CCl | |
| AKOS005252849 | 311.787 | C13 H14 Cl N3 O2 S | UGXTUTVABVAOBU-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O2S/c1-9(2)17-7-13(19-16-17)15-12(18)8-20-11-5-3-10(14)4-6-11/h3-7,9H,8H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2ccc(cc2)Cl | |
| AKOS005215002 | 295.722 | C13 H14 Cl N3 O3 | XCNGLIAJQFCMSV-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O3/c1-9(18)15-13-12(7-14)17(16-20-13)8-10-3-5-11(19-2)6-4-10/h3-6H,7-8H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2)OC)CCl | |
| AKOS005215060 | 295.722 | C13 H14 Cl N3 O3 | OTJJCMUDDKBOGA-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O3/c1-8(18)12-13(15-9(2)19)20-16-17(12)7-10-5-3-4-6-11(10)14/h3-6,8,18H,7H2,1-2H3 | CC(c1c(on[n+]1Cc2ccccc2Cl)[N-]C(=O)C)O | |
| AKOS005215696 | 295.722 | C13 H14 Cl N3 O3 | JCJXMMDGXOMWLX-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O3/c1-19-11-5-3-2-4-10(11)6-7-17-9-13(20-16-17)15-12(18)8-14/h2-5,9H,6-8H2,1H3 | COc1ccccc1CC[n+]2cc(on2)[N-]C(=O)CCl | |
| AKOS005250383 | 295.722 | C13 H14 Cl N3 O3 | SAMMOCMEIIDWAH-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O3/c1-16(8-11-13(19)20-15-17(11)2)12(18)7-9-3-5-10(14)6-4-9/h3-6H,7-8H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)Cc2ccc(cc2)Cl | |
| AKOS005251402 | 327.787 | C13 H14 Cl N3 O3 S | ZTJFZNOLFUPPMV-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O3S/c1-7-9(14)5-4-6-10(7)15-11(18)8(2)21-12-13(19)20-16-17(12)3/h4-6,8H,1-3H3,(H-,15,16,18,19) | Cc1c(cccc1Cl)NC(=O)C(C)Sc2c(on[n+]2C)[O-] | |
| AKOS005251403 | 327.787 | C13 H14 Cl N3 O3 S | MVXDEJBOXNSBFP-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O3S/c1-7-4-5-9(6-10(7)14)15-11(18)8(2)21-12-13(19)20-16-17(12)3/h4-6,8H,1-3H3,(H-,15,16,18,19) | Cc1ccc(cc1Cl)NC(=O)C(C)Sc2c(on[n+]2C)[O-] | |
| AKOS005251404 | 327.787 | C13 H14 Cl N3 O3 S | JJLRIWMHDPOKHQ-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O3S/c1-7-4-5-9(14)6-10(7)15-11(18)8(2)21-12-13(19)20-16-17(12)3/h4-6,8H,1-3H3,(H-,15,16,18,19) | Cc1ccc(cc1NC(=O)C(C)Sc2c(on[n+]2C)[O-])Cl | |
| AKOS005251682 | 327.787 | C13 H14 Cl N3 O3 S | ZKLHIBUIFCHJEI-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O3S/c1-3-10(21-12-13(19)20-16-17(12)2)11(18)15-9-6-4-8(14)5-7-9/h4-7,10H,3H2,1-2H3,(H-,15,16,18,19) | CCC(C(=O)Nc1ccc(cc1)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005251696 | 327.787 | C13 H14 Cl N3 O3 S | MLAZOHXHUYGWLM-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O3S/c1-3-10(21-12-13(19)20-16-17(12)2)11(18)15-9-7-5-4-6-8(9)14/h4-7,10H,3H2,1-2H3,(H-,15,16,18,19) | CCC(C(=O)Nc1ccccc1Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005251737 | 327.787 | C13 H14 Cl N3 O3 S | NJXWYPSQKMPWJG-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O3S/c1-3-10(21-12-13(19)20-16-17(12)2)11(18)15-9-6-4-5-8(14)7-9/h4-7,10H,3H2,1-2H3,(H-,15,16,18,19) | CCC(C(=O)Nc1cccc(c1)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005252294 | 327.787 | C13 H14 Cl N3 O3 S | AUGJHOLSLHVAOV-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O3S/c1-8-9(14)4-3-5-10(8)15-11(18)6-7-21-12-13(19)20-16-17(12)2/h3-5H,6-7H2,1-2H3,(H-,15,16,18,19) | Cc1c(cccc1Cl)NC(=O)CCSc2c(on[n+]2C)[O-] | |
| AKOS005252295 | 327.787 | C13 H14 Cl N3 O3 S | UPDAMRRVPUHUIG-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O3S/c1-8-3-4-9(7-10(8)14)15-11(18)5-6-21-12-13(19)20-16-17(12)2/h3-4,7H,5-6H2,1-2H3,(H-,15,16,18,19) | Cc1ccc(cc1Cl)NC(=O)CCSc2c(on[n+]2C)[O-] | |
| AKOS005252296 | 327.787 | C13 H14 Cl N3 O3 S | RJGGIBIWDNDKQB-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O3S/c1-8-3-4-9(14)7-10(8)15-11(18)5-6-21-12-13(19)20-16-17(12)2/h3-4,7H,5-6H2,1-2H3,(H-,15,16,18,19) | Cc1ccc(cc1NC(=O)CCSc2c(on[n+]2C)[O-])Cl | |
| AKOS005253287 | 327.787 | C13 H14 Cl N3 O3 S | WSZWWLNUJKSVTQ-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O3S/c1-19-7-6-17-8-13(20-16-17)15-12(18)9-21-11-4-2-10(14)3-5-11/h2-5,8H,6-7,9H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2ccc(cc2)Cl | |
| AKOS005251107 | 343.786 | C13 H14 Cl N3 O4 S | ITPYZHGDANRGJD-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O4S/c1-7-4-9(10(20-3)5-8(7)14)15-11(18)6-22-12-13(19)21-16-17(12)2/h4-5H,6H2,1-3H3,(H-,15,16,18,19) | Cc1cc(c(cc1Cl)OC)NC(=O)CSc2c(on[n+]2C)[O-] | |
| AKOS005251446 | 343.786 | C13 H14 Cl N3 O4 S | NMOOZAWYANTHFA-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O4S/c1-7(22-12-13(19)21-16-17(12)2)11(18)15-8-4-5-10(20-3)9(14)6-8/h4-7H,1-3H3,(H-,15,16,18,19) | CC(C(=O)Nc1ccc(c(c1)Cl)OC)Sc2c(on[n+]2C)[O-] | |
| AKOS005251447 | 343.786 | C13 H14 Cl N3 O4 S | ZXPCYMJAHSKYGA-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O4S/c1-7(22-12-13(19)21-16-17(12)2)11(18)15-9-6-8(14)4-5-10(9)20-3/h4-7H,1-3H3,(H-,15,16,18,19) | CC(C(=O)Nc1cc(ccc1OC)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005252371 | 343.786 | C13 H14 Cl N3 O4 S | CEEUDEMMMVXGPK-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O4S/c1-17-12(13(19)21-16-17)22-6-5-11(18)15-8-3-4-10(20-2)9(14)7-8/h3-4,7H,5-6H2,1-2H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(c(c2)Cl)OC | |
| AKOS005252372 | 343.786 | C13 H14 Cl N3 O4 S | OXSNLGKIEKSRIV-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O4S/c1-17-12(13(19)21-16-17)22-6-5-11(18)15-9-7-8(14)3-4-10(9)20-2/h3-4,7H,5-6H2,1-2H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cc(ccc2OC)Cl | |
| AKOS005251232 | 359.785 | C13 H14 Cl N3 O5 S | WMAVPTMNBMCYOI-UHFFFAOYSA-N | InChI=1S/C13H14ClN3O5S/c1-17-12(13(19)22-16-17)23-6-11(18)15-8-4-7(14)9(20-2)5-10(8)21-3/h4-5H,6H2,1-3H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2cc(c(cc2OC)OC)Cl | |
| AKOS005214958 | 329.182 | C13 H14 Cl2 N4 O2 | DRBZYYFGCWJOOJ-UHFFFAOYSA-N | InChI=1S/C13H14Cl2N4O2/c1-8(20)17-13-12(6-16-2)19(18-21-13)7-9-3-4-10(14)5-11(9)15/h3-5,16H,6-7H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2Cl)Cl)CNC | |
| AKOS005215045 | 279.267 | C13 H14 F N3 O3 | LQEQDMLMDXEKIU-UHFFFAOYSA-N | InChI=1S/C13H14FN3O3/c1-8(18)12-13(15-9(2)19)20-16-17(12)7-10-3-5-11(14)6-4-10/h3-6,8,18H,7H2,1-2H3 | CC(c1c(on[n+]1Cc2ccc(cc2)F)[N-]C(=O)C)O | |
| AKOS005252072 | 311.332 | C13 H14 F N3 O3 S | FDLBQYCDOLAHTJ-UHFFFAOYSA-N | InChI=1S/C13H14FN3O3S/c1-3-10(21-12-13(19)20-16-17(12)2)11(18)15-9-7-5-4-6-8(9)14/h4-7,10H,3H2,1-2H3,(H-,15,16,18,19) | CCC(C(=O)Nc1ccccc1F)Sc2c(on[n+]2C)[O-] | |
| AKOS005252087 | 311.332 | C13 H14 F N3 O3 S | KDCKLIKPCRUYEK-UHFFFAOYSA-N | InChI=1S/C13H14FN3O3S/c1-3-10(21-12-13(19)20-16-17(12)2)11(18)15-9-6-4-8(14)5-7-9/h4-7,10H,3H2,1-2H3,(H-,15,16,18,19) | CCC(C(=O)Nc1ccc(cc1)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005252096 | 419.238 | C13 H14 I N3 O3 S | KSFDVSAXRNEODW-UHFFFAOYSA-N | InChI=1S/C13H14IN3O3S/c1-3-10(21-12-13(19)20-16-17(12)2)11(18)15-9-6-4-8(14)5-7-9/h4-7,10H,3H2,1-2H3,(H-,15,16,18,19) | CCC(C(=O)Nc1ccc(cc1)I)Sc2c(on[n+]2C)[O-] | |
| AKOS005215676 | 258.348 | C13 H14 N2 O2 Si | YCRTVVXFCDJEMY-UHFFFAOYSA-N | InChI=1S/C13H14N2O2Si/c1-18(2,3)10-9-12-13(16)17-14-15(12)11-7-5-4-6-8-11/h4-8H,1-3H3 | C[Si](C)(C)C#Cc1c(on[n+]1c2ccccc2)[O-] | MFCD09881647 |
| AKOS005219536 | 310.326 | C13 H14 N2 O5 S | NFLRMENUTMFHMR-UHFFFAOYSA-N | InChI=1S/C13H14N2O5S/c1-3-19-11(16)8-21-12-13(17)20-14-15(12)9-4-6-10(18-2)7-5-9/h4-7H,3,8H2,1-2H3 | CCOC(=O)CSc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005251114 | 322.34 | C13 H14 N4 O4 S | LZPSBUMQAAWICA-UHFFFAOYSA-N | InChI=1S/C13H14N4O4S/c1-8(18)14-9-3-5-10(6-4-9)15-11(19)7-22-12-13(20)21-16-17(12)2/h3-6,16,20H,7H2,1-2H3 | CC(=O)Nc1ccc(cc1)NC(=O)CSc2c(on[n+]2C)[O-] | |
| AKOS005251466 | 322.34 | C13 H14 N4 O4 S | JLPPFENZCRNODG-UHFFFAOYSA-N | InChI=1S/C13H14N4O4S/c1-7(22-12-13(20)21-16-17(12)2)11(19)15-9-5-3-8(4-6-9)10(14)18/h3-7H,1-2H3,(H3-,14,15,16,18,19,20) | CC(C(=O)Nc1ccc(cc1)C(=O)N)Sc2c(on[n+]2C)[O-] | |
| AKOS005251467 | 322.34 | C13 H14 N4 O4 S | SDWSVBQJJGBCRR-UHFFFAOYSA-N | InChI=1S/C13H14N4O4S/c1-7(22-12-13(20)21-16-17(12)2)11(19)15-9-6-4-3-5-8(9)10(14)18/h3-7H,1-2H3,(H3-,14,15,16,18,19,20) | CC(C(=O)Nc1ccccc1C(=O)N)Sc2c(on[n+]2C)[O-] | |
| AKOS005252300 | 322.34 | C13 H14 N4 O4 S | OPNBCGPSMXGFPX-UHFFFAOYSA-N | InChI=1S/C13H14N4O4S/c1-17-12(13(20)21-16-17)22-7-6-10(18)15-9-4-2-8(3-5-9)11(14)19/h2-5H,6-7H2,1H3,(H3-,14,15,16,18,19,20) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2)C(=O)N | |
| AKOS005252301 | 322.34 | C13 H14 N4 O4 S | LKNVPGDWMLUFAJ-UHFFFAOYSA-N | InChI=1S/C13H14N4O4S/c1-17-12(13(20)21-16-17)22-7-6-10(18)15-9-5-3-2-4-8(9)11(14)19/h2-5H,6-7H2,1H3,(H3-,14,15,16,18,19,20) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccccc2C(=O)N | |
| AKOS005219744 | 306.274 | C13 H14 N4 O5 | BDIJGUQHGKGHRO-UHFFFAOYSA-N | InChI=1S/C13H14N4O5/c1-4-20-12(18)8-6(2)21-11(15)7(5-14)9(8)10-13(19)22-16-17(10)3/h9H,4,15H2,1-3H3 | CCOC(=O)C1=C(OC(=C(C1c2c(on[n+]2C)[O-])C#N)N)C | |
| AKOS005251416 | 338.339 | C13 H14 N4 O5 S | IJQQPPOVZQOGAM-UHFFFAOYSA-N | InChI=1S/C13H14N4O5S/c1-7-4-5-9(17(20)21)6-10(7)14-11(18)8(2)23-12-13(19)22-15-16(12)3/h4-6,8H,1-3H3,(H-,14,15,18,19) | Cc1ccc(cc1NC(=O)C(C)Sc2c(on[n+]2C)[O-])[N+](=O)[O-] | |
| AKOS005251504 | 338.339 | C13 H14 N4 O5 S | FZZJWPYADAPAAW-UHFFFAOYSA-N | InChI=1S/C13H14N4O5S/c1-7-6-9(17(20)21)4-5-10(7)14-11(18)8(2)23-12-13(19)22-15-16(12)3/h4-6,8H,1-3H3,(H-,14,15,18,19) | Cc1cc(ccc1NC(=O)C(C)Sc2c(on[n+]2C)[O-])[N+](=O)[O-] | |
| AKOS005252331 | 338.339 | C13 H14 N4 O5 S | ZWAXVFQWOIWNBD-UHFFFAOYSA-N | InChI=1S/C13H14N4O5S/c1-8-7-9(17(20)21)3-4-10(8)14-11(18)5-6-23-12-13(19)22-15-16(12)2/h3-4,7H,5-6H2,1-2H3,(H-,14,15,18,19) | Cc1cc(ccc1NC(=O)CCSc2c(on[n+]2C)[O-])[N+](=O)[O-] | |
| AKOS005252340 | 338.339 | C13 H14 N4 O5 S | MOFUVBGMQWBXNO-UHFFFAOYSA-N | InChI=1S/C13H14N4O5S/c1-8-3-4-9(17(20)21)7-10(8)14-11(18)5-6-23-12-13(19)22-15-16(12)2/h3-4,7H,5-6H2,1-2H3,(H-,14,15,18,19) | Cc1ccc(cc1NC(=O)CCSc2c(on[n+]2C)[O-])[N+](=O)[O-] | |
| AKOS005252714 | 318.354 | C13 H14 N6 O2 S | ZAPPMHVRWMXYHY-UHFFFAOYSA-N | InChI=1S/C13H14N6O2S/c1-9-4-5-10(6-14)13(15-9)22-8-11(20)16-12-7-19(17-21-12)18(2)3/h4-5,7H,8H2,1-3H3 | Cc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)N(C)C)C#N | |
| AKOS005252788 | 318.354 | C13 H14 N6 O2 S | UBTPCPWFNBSJRZ-UHFFFAOYSA-N | InChI=1S/C13H14N6O2S/c1-18(2)19-7-12(21-17-19)16-11(20)8-22-13-14-9-5-3-4-6-10(9)15-13/h3-7H,8H2,1-2H3,(H-,14,15,16,17,20) | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2[nH]c3ccccc3n2 | |
| AKOS005252681 | 346.368 | C13 H14 N8 O2 S | SQDPYXTWEIKYIG-UHFFFAOYSA-N | InChI=1S/C13H14N8O2S/c1-19(2)20-8-12(23-18-20)14-11(22)9-24-13-15-16-17-21(13)10-6-4-3-5-7-10/h3-8H,9H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2nnnn2c3ccccc3 | |
| AKOS005214973 | 294.737 | C13 H15 Cl N4 O2 | GHIRYCZMNHVOGV-UHFFFAOYSA-N | InChI=1S/C13H15ClN4O2/c1-9(19)16-13-12(7-15-2)18(17-20-13)8-10-5-3-4-6-11(10)14/h3-6,15H,7-8H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccccc2Cl)CNC | |
| AKOS005214959 | 278.282 | C13 H15 F N4 O2 | RVDYTQXHKGDIPQ-UHFFFAOYSA-N | InChI=1S/C13H15FN4O2/c1-9(19)16-13-12(7-15-2)18(17-20-13)8-10-3-5-11(14)6-4-10/h3-6,15H,7-8H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2)F)CNC | |
| AKOS005219481 | 337.725 | C13 H15 F3 N3 O2 . Cl | IVDIKJHONFYKLV-UHFFFAOYSA-M | InChI=1S/C13H15F3N3O2.ClH/c1-7(2)19-10(12(17)21-18-19)11(20)8-3-5-9(6-4-8)13(14,15)16;/h3-7,11,20H,17H2,1-2H3;1H/q+1;/p-1 | CC(C)[n+]1c(c(on1)N)C(c2ccc(cc2)C(F)(F)F)O.[Cl-] | |
| AKOS005214824 | 245.277 | C13 H15 N3 O2 | KLRWTCXVPNTBFM-UHFFFAOYSA-N | InChI=1S/C13H15N3O2/c1-9-2-6-11(7-3-9)16-12(13(17)18-15-16)8-14-10-4-5-10/h2-3,6-7,10,14H,4-5,8H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC3 | |
| AKOS005214846 | 245.277 | C13 H15 N3 O2 | ICSLEJKVNZKRFI-UHFFFAOYSA-N | InChI=1S/C13H15N3O2/c1-3-8-14-9-12-13(17)18-15-16(12)11-6-4-10(2)5-7-11/h3-7,14H,1,8-9H2,2H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCC=C | |
| AKOS005215506 | 245.277 | C13 H15 N3 O2 | MGZOTIRKGUTULL-UHFFFAOYSA-N | InChI=1S/C13H15N3O2/c1-2-3-9-16-10-12(18-15-16)14-13(17)11-7-5-4-6-8-11/h4-8,10H,2-3,9H2,1H3 | CCCC[n+]1cc(on1)[N-]C(=O)c2ccccc2 | |
| AKOS005215574 | 245.277 | C13 H15 N3 O2 | OGKAHKFBVBSOFO-UHFFFAOYSA-N | InChI=1S/C13H15N3O2/c1-10(2)16-9-13(18-15-16)14-12(17)8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)Cc2ccccc2 | |
| AKOS005215620 | 277.342 | C13 H15 N3 O2 S | GLLKRYGCTNUOAC-UHFFFAOYSA-N | InChI=1S/C13H15N3O2S/c1-9(2)16-13(19-3)12(18-15-16)14-11(17)10-7-5-4-6-8-10/h4-9H,1-3H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)SC | |
| AKOS005219460 | 277.342 | C13 H15 N3 O2 S | KMHHMQFLGVNROZ-UHFFFAOYSA-N | InChI=1S/C13H15N3O2S/c1-10(2)16-8-13(18-15-16)14-12(17)9-19-11-6-4-3-5-7-11/h3-8,10H,9H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2ccccc2 | |
| AKOS005252445 | 277.342 | C13 H15 N3 O2 S | XWVYECRSZHAXSV-UHFFFAOYSA-N | InChI=1S/C13H15N3O2S/c1-2-16-8-13(18-15-16)14-12(17)10-19-9-11-6-4-3-5-7-11/h3-8H,2,9-10H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSCc2ccccc2 | |
| AKOS005252446 | 277.342 | C13 H15 N3 O2 S | LBVZDDNZRTZERG-UHFFFAOYSA-N | InChI=1S/C13H15N3O2S/c1-3-16-8-13(18-15-16)14-12(17)9-19-11-6-4-10(2)5-7-11/h4-8H,3,9H2,1-2H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2ccc(cc2)C | |
| AKOS005214821 | 261.276 | C13 H15 N3 O3 | NRTPPVGXBBGTKA-UHFFFAOYSA-N | InChI=1S/C13H15N3O3/c1-18-11-6-4-10(5-7-11)16-12(13(17)19-15-16)8-14-9-2-3-9/h4-7,9,14H,2-3,8H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC3 | |
| AKOS005214843 | 261.276 | C13 H15 N3 O3 | VPPOCZZOQRQTDS-UHFFFAOYSA-N | InChI=1S/C13H15N3O3/c1-3-8-14-9-12-13(17)19-15-16(12)10-4-6-11(18-2)7-5-10/h3-7,14H,1,8-9H2,2H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCC=C | |
| AKOS005214940 | 261.276 | C13 H15 N3 O3 | PXEYYHGCCVQDIE-UHFFFAOYSA-N | InChI=1S/C13H15N3O3/c1-9-3-5-11(6-4-9)7-16-12(8-17)13(19-15-16)14-10(2)18/h3-6,17H,7-8H2,1-2H3 | Cc1ccc(cc1)C[n+]2c(c(on2)[N-]C(=O)C)CO | |
| AKOS005214953 | 261.276 | C13 H15 N3 O3 | UHUXEZZOSCWJBZ-UHFFFAOYSA-N | InChI=1S/C13H15N3O3/c1-10(18)14-13-12(9-17)16(15-19-13)8-7-11-5-3-2-4-6-11/h2-6,17H,7-9H2,1H3 | CC(=O)[N-]c1c([n+](no1)CCc2ccccc2)CO | |
| AKOS005215029 | 261.276 | C13 H15 N3 O3 | KNDZQMKWQMEUGC-UHFFFAOYSA-N | InChI=1S/C13H15N3O3/c1-9(17)12-13(14-10(2)18)19-15-16(12)8-11-6-4-3-5-7-11/h3-7,9,17H,8H2,1-2H3 | CC(c1c(on[n+]1Cc2ccccc2)[N-]C(=O)C)O | |
| AKOS005215557 | 261.276 | C13 H15 N3 O3 | VTSFISLDBUNGGP-UHFFFAOYSA-N | InChI=1S/C13H15N3O3/c1-10(17)14-13-9-16(15-19-13)8-7-11-5-3-4-6-12(11)18-2/h3-6,9H,7-8H2,1-2H3 | CC(=O)[N-]c1c[n+](no1)CCc2ccccc2OC | |
| AKOS005215580 | 261.276 | C13 H15 N3 O3 | VLMLXUMOCQWXSX-UHFFFAOYSA-N | InChI=1S/C13H15N3O3/c1-9(2)16-11(8-17)13(19-15-16)14-12(18)10-6-4-3-5-7-10/h3-7,9,17H,8H2,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CO | |
| AKOS005250246 | 261.276 | C13 H15 N3 O3 | SLPDCNGOKZKUHZ-UHFFFAOYSA-N | InChI=1S/C13H15N3O3/c1-9-5-4-6-10(7-9)12(17)15(2)8-11-13(18)19-14-16(11)3/h4-7H,8H2,1-3H3 | Cc1cccc(c1)C(=O)N(C)Cc2c(on[n+]2C)[O-] | |
| AKOS005250247 | 261.276 | C13 H15 N3 O3 | HIPJCZBOPMHGIJ-UHFFFAOYSA-N | InChI=1S/C13H15N3O3/c1-9-4-6-10(7-5-9)12(17)15(2)8-11-13(18)19-14-16(11)3/h4-7H,8H2,1-3H3 | Cc1ccc(cc1)C(=O)N(C)Cc2c(on[n+]2C)[O-] | |
| AKOS005250375 | 261.276 | C13 H15 N3 O3 | OJKIFHPPXGJQCE-UHFFFAOYSA-N | InChI=1S/C13H15N3O3/c1-15(9-11-13(18)19-14-16(11)2)12(17)8-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)Cc2ccccc2 | |
| AKOS005250377 | 261.276 | C13 H15 N3 O3 | VQRNCTNBNWNWIZ-UHFFFAOYSA-N | InChI=1S/C13H15N3O3/c1-9-6-4-5-7-10(9)12(17)15(2)8-11-13(18)19-14-16(11)3/h4-7H,8H2,1-3H3 | Cc1ccccc1C(=O)N(C)Cc2c(on[n+]2C)[O-] | |
| AKOS005250485 | 261.276 | C13 H15 N3 O3 | IRLQZQDVYPAQMO-UHFFFAOYSA-N | InChI=1S/C13H15N3O3/c1-3-15(4-2)12(17)11-13(18)19-14-16(11)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3 | CCN(CC)C(=O)c1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005250514 | 261.276 | C13 H15 N3 O3 | JDRLEQJYUSTOGD-UHFFFAOYSA-N | InChI=1S/C13H15N3O3/c1-8(2)9-4-6-10(7-5-9)14-12(17)11-13(18)19-15-16(11)3/h4-8H,1-3H3,(H-,14,15,17,18) | CC(C)c1ccc(cc1)NC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005250527 | 261.276 | C13 H15 N3 O3 | GLOAFDRTEILIPW-UHFFFAOYSA-N | InChI=1S/C13H15N3O3/c1-4-9-7-5-6-8(2)10(9)14-12(17)11-13(18)19-15-16(11)3/h5-7H,4H2,1-3H3,(H-,14,15,17,18) | CCc1cccc(c1NC(=O)c2c(on[n+]2C)[O-])C | |
| AKOS005251108 | 293.342 | C13 H15 N3 O3 S | OOPLCDVISQCLLN-UHFFFAOYSA-N | InChI=1S/C13H15N3O3S/c1-8-5-4-6-9(2)11(8)14-10(17)7-20-12-13(18)19-15-16(12)3/h4-6H,7H2,1-3H3,(H-,14,15,17,18) | Cc1cccc(c1NC(=O)CSc2c(on[n+]2C)[O-])C | |
| AKOS005251217 | 293.342 | C13 H15 N3 O3 S | USQDCDFPGXBBDI-UHFFFAOYSA-N | InChI=1S/C13H15N3O3S/c1-8-5-4-6-10(9(8)2)14-11(17)7-20-12-13(18)19-15-16(12)3/h4-6H,7H2,1-3H3,(H-,14,15,17,18) | Cc1cccc(c1C)NC(=O)CSc2c(on[n+]2C)[O-] | |
| AKOS005251218 | 293.342 | C13 H15 N3 O3 S | VTXQWSBOCYVXIG-UHFFFAOYSA-N | InChI=1S/C13H15N3O3S/c1-8-4-5-10(9(2)6-8)14-11(17)7-20-12-13(18)19-15-16(12)3/h4-6H,7H2,1-3H3,(H-,14,15,17,18) | Cc1ccc(c(c1)C)NC(=O)CSc2c(on[n+]2C)[O-] | |
| AKOS005251219 | 293.342 | C13 H15 N3 O3 S | VWIVXCLHOSNWPW-UHFFFAOYSA-N | InChI=1S/C13H15N3O3S/c1-8-4-5-9(2)10(6-8)14-11(17)7-20-12-13(18)19-15-16(12)3/h4-6H,7H2,1-3H3,(H-,14,15,17,18) | Cc1ccc(c(c1)NC(=O)CSc2c(on[n+]2C)[O-])C | |
| AKOS005251229 | 293.342 | C13 H15 N3 O3 S | WJVPNCGCTYMUFV-UHFFFAOYSA-N | InChI=1S/C13H15N3O3S/c1-8-4-5-10(6-9(8)2)14-11(17)7-20-12-13(18)19-15-16(12)3/h4-6H,7H2,1-3H3,(H-,14,15,17,18) | Cc1ccc(cc1C)NC(=O)CSc2c(on[n+]2C)[O-] | |
| AKOS005251230 | 293.342 | C13 H15 N3 O3 S | DRZVWKYBVRZGTR-UHFFFAOYSA-N | InChI=1S/C13H15N3O3S/c1-8-4-9(2)6-10(5-8)14-11(17)7-20-12-13(18)19-15-16(12)3/h4-6H,7H2,1-3H3,(H-,14,15,17,18) | Cc1cc(cc(c1)NC(=O)CSc2c(on[n+]2C)[O-])C | |
| AKOS005251425 | 293.342 | C13 H15 N3 O3 S | BNZFCAIGSPLXBR-UHFFFAOYSA-N | InChI=1S/C13H15N3O3S/c1-8-6-4-5-7-10(8)14-11(17)9(2)20-12-13(18)19-15-16(12)3/h4-7,9H,1-3H3,(H-,14,15,17,18) | Cc1ccccc1NC(=O)C(C)Sc2c(on[n+]2C)[O-] | |
| AKOS005251433 | 293.342 | C13 H15 N3 O3 S | CAIFNNIQWHRVJG-UHFFFAOYSA-N | InChI=1S/C13H15N3O3S/c1-8-5-4-6-10(7-8)14-11(17)9(2)20-12-13(18)19-15-16(12)3/h4-7,9H,1-3H3,(H-,14,15,17,18) | Cc1cccc(c1)NC(=O)C(C)Sc2c(on[n+]2C)[O-] | |
| AKOS005251434 | 293.342 | C13 H15 N3 O3 S | PZFGQWMKUPTPEQ-UHFFFAOYSA-N | InChI=1S/C13H15N3O3S/c1-8-4-6-10(7-5-8)14-11(17)9(2)20-12-13(18)19-15-16(12)3/h4-7,9H,1-3H3,(H-,14,15,17,18) | Cc1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2C)[O-] | |
| AKOS005251687 | 293.342 | C13 H15 N3 O3 S | ILIFAWSUFGVANB-UHFFFAOYSA-N | InChI=1S/C13H15N3O3S/c1-3-10(20-12-13(18)19-15-16(12)2)11(17)14-9-7-5-4-6-8-9/h4-8,10H,3H2,1-2H3,(H-,14,15,17,18) | CCC(C(=O)Nc1ccccc1)Sc2c(on[n+]2C)[O-] | |
| AKOS005252339 | 293.342 | C13 H15 N3 O3 S | HODYMZWIEVBXLG-UHFFFAOYSA-N | InChI=1S/C13H15N3O3S/c1-9-5-3-4-6-10(9)14-11(17)7-8-20-12-13(18)19-15-16(12)2/h3-6H,7-8H2,1-2H3,(H-,14,15,17,18) | Cc1ccccc1NC(=O)CCSc2c(on[n+]2C)[O-] | |
| AKOS005252348 | 293.342 | C13 H15 N3 O3 S | LUCLHZLUAXSYFT-UHFFFAOYSA-N | InChI=1S/C13H15N3O3S/c1-9-4-3-5-10(8-9)14-11(17)6-7-20-12-13(18)19-15-16(12)2/h3-5,8H,6-7H2,1-2H3,(H-,14,15,17,18) | Cc1cccc(c1)NC(=O)CCSc2c(on[n+]2C)[O-] | |
| AKOS005252349 | 293.342 | C13 H15 N3 O3 S | DVSFBSRZYDWPKB-UHFFFAOYSA-N | InChI=1S/C13H15N3O3S/c1-9-3-5-10(6-4-9)14-11(17)7-8-20-12-13(18)19-15-16(12)2/h3-6H,7-8H2,1-2H3,(H-,14,15,17,18) | Cc1ccc(cc1)NC(=O)CCSc2c(on[n+]2C)[O-] | |
| AKOS005253393 | 293.342 | C13 H15 N3 O3 S | QUEINRQUMRQIBU-UHFFFAOYSA-N | InChI=1S/C13H15N3O3S/c1-18-8-7-16-9-13(19-15-16)14-12(17)10-20-11-5-3-2-4-6-11/h2-6,9H,7-8,10H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2ccccc2 | |
| AKOS005214951 | 277.276 | C13 H15 N3 O4 | VADOJVTZQMHXSI-UHFFFAOYSA-N | InChI=1S/C13H15N3O4/c1-9(18)14-13-12(8-17)16(15-20-13)7-10-3-5-11(19-2)6-4-10/h3-6,17H,7-8H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2)OC)CO | |
| AKOS005215583 | 277.276 | C13 H15 N3 O4 | GDKGGGDIORDYQG-UHFFFAOYSA-N | InChI=1S/C13H15N3O4/c1-9(17)15(2)8-12-13(18)20-14-16(12)10-4-6-11(19-3)7-5-10/h4-7H,8H2,1-3H3 | CC(=O)N(C)Cc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005250243 | 277.276 | C13 H15 N3 O4 | MMOGSYVUTCEMDI-UHFFFAOYSA-N | InChI=1S/C13H15N3O4/c1-15(8-11-13(18)20-14-16(11)2)12(17)9-5-4-6-10(7-9)19-3/h4-7H,8H2,1-3H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)c2cccc(c2)OC | |
| AKOS005250244 | 277.276 | C13 H15 N3 O4 | TUIDKTWLHGFOJD-UHFFFAOYSA-N | InChI=1S/C13H15N3O4/c1-15(8-11-13(18)20-14-16(11)2)12(17)9-4-6-10(19-3)7-5-9/h4-7H,8H2,1-3H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)c2ccc(cc2)OC | |
| AKOS005250365 | 277.276 | C13 H15 N3 O4 | XDOMFYYLKASSMM-UHFFFAOYSA-N | InChI=1S/C13H15N3O4/c1-15(8-11-13(18)20-14-16(11)2)12(17)9-19-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)COc2ccccc2 | |
| AKOS005215549 | 309.341 | C13 H15 N3 O4 S | VLFOIOOBYAUGPU-UHFFFAOYSA-N | InChI=1S/C13H15N3O4S/c1-9(2)16-13(21(3,18)19)12(20-15-16)14-11(17)10-7-5-4-6-8-10/h4-9H,1-3H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)S(=O)(=O)C | |
| AKOS005219484 | 309.341 | C13 H15 N3 O4 S | INNAPMPTKYIQRS-UHFFFAOYSA-N | InChI=1S/C13H15N3O4S/c1-9(2)16-12(8-17)13(20-15-16)14-21(18,19)11-6-4-10(3)5-7-11/h4-9H,1-3H3 | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)C=O | |
| AKOS005251111 | 309.341 | C13 H15 N3 O4 S | XWHHMYQVZTUYSR-UHFFFAOYSA-N | InChI=1S/C13H15N3O4S/c1-3-19-10-6-4-9(5-7-10)14-11(17)8-21-12-13(18)20-15-16(12)2/h4-7H,3,8H2,1-2H3,(H-,14,15,17,18) | CCOc1ccc(cc1)NC(=O)CSc2c(on[n+]2C)[O-] | |
| AKOS005251249 | 309.341 | C13 H15 N3 O4 S | BQEMKQFFVQARHK-UHFFFAOYSA-N | InChI=1S/C13H15N3O4S/c1-3-19-10-7-5-4-6-9(10)14-11(17)8-21-12-13(18)20-15-16(12)2/h4-7H,3,8H2,1-2H3,(H-,14,15,17,18) | CCOc1ccccc1NC(=O)CSc2c(on[n+]2C)[O-] | |
| AKOS005251482 | 309.341 | C13 H15 N3 O4 S | OZEZGCXPTDHYOG-UHFFFAOYSA-N | InChI=1S/C13H15N3O4S/c1-8(21-12-13(18)20-15-16(12)2)11(17)14-9-6-4-5-7-10(9)19-3/h4-8H,1-3H3,(H-,14,15,17,18) | CC(C(=O)Nc1ccccc1OC)Sc2c(on[n+]2C)[O-] | |
| AKOS005251483 | 309.341 | C13 H15 N3 O4 S | NCIVEOFDAQVZGJ-UHFFFAOYSA-N | InChI=1S/C13H15N3O4S/c1-8(21-12-13(18)20-15-16(12)2)11(17)14-9-5-4-6-10(7-9)19-3/h4-8H,1-3H3,(H-,14,15,17,18) | CC(C(=O)Nc1cccc(c1)OC)Sc2c(on[n+]2C)[O-] | |
| AKOS005251484 | 309.341 | C13 H15 N3 O4 S | QQIXQKINYGIGPV-UHFFFAOYSA-N | InChI=1S/C13H15N3O4S/c1-8(21-12-13(18)20-15-16(12)2)11(17)14-9-4-6-10(19-3)7-5-9/h4-8H,1-3H3,(H-,14,15,17,18) | CC(C(=O)Nc1ccc(cc1)OC)Sc2c(on[n+]2C)[O-] | |
| AKOS005252308 | 309.341 | C13 H15 N3 O4 S | KDOKEAMIXNJFJT-UHFFFAOYSA-N | InChI=1S/C13H15N3O4S/c1-16-12(13(18)20-15-16)21-8-7-11(17)14-9-5-3-4-6-10(9)19-2/h3-6H,7-8H2,1-2H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccccc2OC | |
| AKOS005252309 | 309.341 | C13 H15 N3 O4 S | VEYRHSMGWOJVRR-UHFFFAOYSA-N | InChI=1S/C13H15N3O4S/c1-16-12(13(18)20-15-16)21-7-6-11(17)14-9-4-3-5-10(8-9)19-2/h3-5,8H,6-7H2,1-2H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cccc(c2)OC | |
| AKOS005252310 | 309.341 | C13 H15 N3 O4 S | MWQKMKFFSAOJMB-UHFFFAOYSA-N | InChI=1S/C13H15N3O4S/c1-16-12(13(18)20-15-16)21-8-7-11(17)14-9-3-5-10(19-2)6-4-9/h3-6H,7-8H2,1-2H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2)OC | |
| AKOS005251244 | 325.34 | C13 H15 N3 O5 S | OSKSXDHIUFIKPQ-UHFFFAOYSA-N | InChI=1S/C13H15N3O5S/c1-16-12(13(18)21-15-16)22-7-11(17)14-9-5-4-8(19-2)6-10(9)20-3/h4-6H,7H2,1-3H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2OC)OC | |
| AKOS005251245 | 325.34 | C13 H15 N3 O5 S | UDMNCBZVTLKEID-UHFFFAOYSA-N | InChI=1S/C13H15N3O5S/c1-16-12(13(18)21-15-16)22-7-11(17)14-9-6-8(19-2)4-5-10(9)20-3/h4-6H,7H2,1-3H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2cc(ccc2OC)OC | |
| AKOS005251246 | 325.34 | C13 H15 N3 O5 S | ZKRRHJXNPOGGRX-UHFFFAOYSA-N | InChI=1S/C13H15N3O5S/c1-16-12(13(18)21-15-16)22-7-11(17)14-8-4-9(19-2)6-10(5-8)20-3/h4-6H,7H2,1-3H3,(H-,14,15,17,18) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2cc(cc(c2)OC)OC | |
| AKOS005252970 | 321.355 | C13 H15 N5 O3 S | NZAPYDDXPLWWBK-UHFFFAOYSA-N | InChI=1S/C13H15N5O3S/c19-11(10-22-13-3-1-2-4-14-13)15-12-9-18(16-21-12)17-5-7-20-8-6-17/h1-4,9H,5-8,10H2 | c1ccnc(c1)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3 | |
| AKOS005219472 | 305.289 | C13 H15 N5 O4 | FBWHEDMYCKOTRJ-UHFFFAOYSA-N | InChI=1S/C13H15N5O4/c1-5-18-10(6-9(7-14)8-15)11(21-17-18)16-22-12(19)20-13(2,3)4/h6H,5H2,1-4H3 | CC[n+]1c(c(on1)[N-]OC(=O)OC(C)(C)C)C=C(C#N)C#N | |
| AKOS005214193 | 281.738 | C13 H16 Cl N3 O2 | LDNOPZYFZMJVIM-UHFFFAOYSA-N | InChI=1S/C13H16ClN3O2/c1-9(2)17-12(13(18)19-16-17)8-15-7-10-5-3-4-6-11(10)14/h3-6,9,15H,7-8H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCc2ccccc2Cl | |
| AKOS005214208 | 265.283 | C13 H16 F N3 O2 | ZLXMYNPMWSNMNY-UHFFFAOYSA-N | InChI=1S/C13H16FN3O2/c1-9(2)17-12(13(18)19-16-17)8-15-7-10-3-5-11(14)6-4-10/h3-6,9,15H,7-8H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCc2ccc(cc2)F | |
| AKOS005214864 | 260.292 | C13 H16 N4 O2 | YGCQKRUBMGZYOH-UHFFFAOYSA-N | InChI=1S/C13H16N4O2/c1-10(18)15-13-12(9-14)17(16-19-13)8-7-11-5-3-2-4-6-11/h2-6H,7-9,14H2,1H3 | CC(=O)[N-]c1c([n+](no1)CCc2ccccc2)CN | |
| AKOS005214946 | 260.292 | C13 H16 N4 O2 | SKJMFXXENFUBDO-UHFFFAOYSA-N | InChI=1S/C13H16N4O2/c1-10(18)15-13-12(8-14-2)17(16-19-13)9-11-6-4-3-5-7-11/h3-7,14H,8-9H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccccc2)CNC | |
| AKOS005215079 | 260.292 | C13 H16 N4 O2 | ZVMAZWOSKGVKBJ-UHFFFAOYSA-N | InChI=1S/C13H16N4O2/c1-9-3-5-11(6-4-9)8-17-12(7-14)13(19-16-17)15-10(2)18/h3-6H,7-8,14H2,1-2H3 | Cc1ccc(cc1)C[n+]2c(c(on2)[N-]C(=O)C)CN | |
| AKOS005219785 | 292.357 | C13 H16 N4 O2 S | GRJWKIALPWSYID-UHFFFAOYSA-N | InChI=1S/C13H16N4O2S/c1-3-14-13(20)16(2)9-11-12(18)19-15-17(11)10-7-5-4-6-8-10/h4-8H,3,9H2,1-2H3,(H-,14,15,18,20) | CCNC(=S)N(C)Cc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005250084 | 292.357 | C13 H16 N4 O2 S | OWDNXTMZBXWVIB-UHFFFAOYSA-N | InChI=1S/C13H16N4O2S/c1-14-13(20)17(8-10-6-4-3-5-7-10)9-11-12(18)19-15-16(11)2/h3-7H,8-9H2,1-2H3,(H-,14,15,18,20) | CNC(=S)N(Cc1ccccc1)Cc2c(on[n+]2C)[O-] | |
| AKOS005252683 | 292.357 | C13 H16 N4 O2 S | GUAFYWYMRGZQTR-UHFFFAOYSA-N | InChI=1S/C13H16N4O2S/c1-16(2)17-8-13(19-15-17)14-12(18)10-20-9-11-6-4-3-5-7-11/h3-8H,9-10H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSCc2ccccc2 | |
| AKOS005252684 | 292.357 | C13 H16 N4 O2 S | ACDJVWNVCDWYDU-UHFFFAOYSA-N | InChI=1S/C13H16N4O2S/c1-10-4-6-11(7-5-10)20-9-12(18)14-13-8-17(15-19-13)16(2)3/h4-8H,9H2,1-3H3 | Cc1ccc(cc1)SCC(=O)[N-]c2c[n+](no2)N(C)C | |
| AKOS005252796 | 292.357 | C13 H16 N4 O2 S | JDZMDTRJXWXIOE-UHFFFAOYSA-N | InChI=1S/C13H16N4O2S/c1-9(2)17-7-13(19-16-17)15-12(18)8-20-11-5-3-4-10(14)6-11/h3-7,9H,8,14H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2cccc(c2)N | |
| AKOS005214800 | 276.291 | C13 H16 N4 O3 | XEZSFDIZBOUIJQ-UHFFFAOYSA-N | InChI=1S/C13H16N4O3/c18-13-12(10-14-16-6-8-19-9-7-16)17(15-20-13)11-4-2-1-3-5-11/h1-5,14H,6-10H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNN3CCOCC3 | |
| AKOS005214862 | 276.291 | C13 H16 N4 O3 | UTXVAJULTKLRAN-UHFFFAOYSA-N | InChI=1S/C13H16N4O3/c1-9(18)15-13-12(7-14)17(16-20-13)8-10-3-5-11(19-2)6-4-10/h3-6H,7-8,14H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2)OC)CN | |
| AKOS005215608 | 276.291 | C13 H16 N4 O3 | BHVDTYVBCHDWFS-UHFFFAOYSA-N | InChI=1S/C13H16N4O3/c1-8(2)17-11(13(20-16-17)15-9(3)18)12(19)10-5-4-6-14-7-10/h4-8,12,19H,1-3H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)C)C(c2cccnc2)O | |
| AKOS005219871 | 308.356 | C13 H16 N4 O3 S | FOSAXOKEKYDDOY-UHFFFAOYSA-N | InChI=1S/C13H16N4O3S/c1-16-11(12(19)20-15-16)9-17(7-8-18)13(21)14-10-5-3-2-4-6-10/h2-6,18H,7-9H2,1H3,(H-,14,15,19,21) | C[n+]1c(c(on1)[O-])CN(CCO)C(=S)Nc2ccccc2 | |
| AKOS005250083 | 308.356 | C13 H16 N4 O3 S | YWRHVTURFSKLGB-UHFFFAOYSA-N | InChI=1S/C13H16N4O3S/c1-14-13(21)16(2)8-11-12(18)20-15-17(11)9-4-6-10(19-3)7-5-9/h4-7H,8H2,1-3H3,(H-,14,15,18,21) | CNC(=S)N(C)Cc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005250086 | 308.356 | C13 H16 N4 O3 S | BMFHDAAHPBIEOG-UHFFFAOYSA-N | InChI=1S/C13H16N4O3S/c1-14-13(21)16(7-8-18)9-11-12(19)20-15-17(11)10-5-3-2-4-6-10/h2-6,18H,7-9H2,1H3,(H-,14,15,19,21) | CNC(=S)N(CCO)Cc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005253376 | 308.356 | C13 H16 N4 O3 S | JHUXXBCGQJFUIY-UHFFFAOYSA-N | InChI=1S/C13H16N4O3S/c1-19-6-5-17-8-13(20-16-17)15-12(18)9-21-11-4-2-3-10(14)7-11/h2-4,7-8H,5-6,9,14H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2cccc(c2)N | |
| AKOS005253033 | 324.356 | C13 H16 N4 O4 S | LLJKXQCBOYPDPW-UHFFFAOYSA-N | InChI=1S/C13H16N4O4S/c18-12(10-22-9-11-2-1-5-20-11)14-13-8-17(15-21-13)16-3-6-19-7-4-16/h1-2,5,8H,3-4,6-7,9-10H2 | c1cc(oc1)CSCC(=O)[N-]c2c[n+](no2)N3CCOCC3 | |
| AKOS005252011 | 372.42 | C13 H16 N4 O5 S2 | BYCUIWOSCFMBJH-UHFFFAOYSA-N | InChI=1S/C13H16N4O5S2/c1-3-10(23-12-13(19)22-16-17(12)2)11(18)15-8-4-6-9(7-5-8)24(14,20)21/h4-7,10H,3H2,1-2H3,(H3-,14,15,16,18,19,20,21) | CCC(C(=O)Nc1ccc(cc1)S(=O)(=O)N)Sc2c(on[n+]2C)[O-] | |
| AKOS005253139 | 320.37 | C13 H16 N6 O2 S | GLLFIYZJDVUJMB-UHFFFAOYSA-N | InChI=1S/C13H16N6O2S/c20-11(10-22-13-14-5-4-6-15-13)16-12-9-19(17-21-12)18-7-2-1-3-8-18/h4-6,9H,1-3,7-8,10H2 | c1cnc(nc1)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3 | |
| AKOS005253156 | 352.369 | C13 H16 N6 O4 S | RDBIHRRXRIQLIW-UHFFFAOYSA-N | InChI=1S/C13H16N6O4S/c20-9-6-10(21)16-13(15-9)24-8-11(22)14-12-7-19(17-23-12)18-4-2-1-3-5-18/h6-7H,1-5,8H2,(H2-,14,15,16,17,20,21,22) | c1c(nc(nc1O)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3)O | |
| AKOS005214211 | 247.293 | C13 H17 N3 O2 | ANNBSPOISVTWKH-UHFFFAOYSA-N | InChI=1S/C13H17N3O2/c1-3-10(2)14-9-12-13(17)18-15-16(12)11-7-5-4-6-8-11/h4-8,10,14H,3,9H2,1-2H3 | CCC(C)NCc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005214212 | 247.293 | C13 H17 N3 O2 | VKFBHPKGMDQAGB-UHFFFAOYSA-N | InChI=1S/C13H17N3O2/c1-13(2,3)14-9-11-12(17)18-15-16(11)10-7-5-4-6-8-10/h4-8,14H,9H2,1-3H3 | CC(C)(C)NCc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005214243 | 247.293 | C13 H17 N3 O2 | GSKIUBPNOJXKOZ-UHFFFAOYSA-N | InChI=1S/C13H17N3O2/c1-10(2)16-12(13(17)18-15-16)9-14-8-11-6-4-3-5-7-11/h3-7,10,14H,8-9H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCc2ccccc2 | |
| AKOS005214152 | 263.292 | C13 H17 N3 O3 | OGVGIQIPTWTVLW-UHFFFAOYSA-N | InChI=1S/C13H17N3O3/c1-16-11(13(17)19-15-16)9-14-8-7-10-5-3-4-6-12(10)18-2/h3-6,14H,7-9H2,1-2H3 | C[n+]1c(c(on1)[O-])CNCCc2ccccc2OC | |
| AKOS005214325 | 263.292 | C13 H17 N3 O3 | XJKGAAKUBKRBCB-UHFFFAOYSA-N | InChI=1S/C13H17N3O3/c1-16-12(13(17)19-15-16)9-14-8-7-10-3-5-11(18-2)6-4-10/h3-6,14H,7-9H2,1-2H3 | C[n+]1c(c(on1)[O-])CNCCc2ccc(cc2)OC | |
| AKOS005214812 | 263.292 | C13 H17 N3 O3 | XTLRSVQHZKLTCE-UHFFFAOYSA-N | InChI=1S/C13H17N3O3/c1-18-9-5-8-14-10-12-13(17)19-15-16(12)11-6-3-2-4-7-11/h2-4,6-7,14H,5,8-10H2,1H3 | COCCCNCc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005214234 | 279.292 | C13 H17 N3 O4 | OYYKOSCZXMKIRL-UHFFFAOYSA-N | InChI=1S/C13H17N3O4/c1-18-12(19-2)9-14-8-11-13(17)20-15-16(11)10-6-4-3-5-7-10/h3-7,12,14H,8-9H2,1-2H3 | COC(CNCc1c(on[n+]1c2ccccc2)[O-])OC | |
| AKOS005215686 | 279.292 | C13 H17 N3 O4 | MZWUECXDASCOEH-UHFFFAOYSA-N | InChI=1S/C13H17N3O4/c1-18-8-7-14-9-12-13(17)20-15-16(12)10-3-5-11(19-2)6-4-10/h3-6,14H,7-9H2,1-2H3 | COCCNCc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005215328 | 311.357 | C13 H17 N3 O4 S | QCUKVZHBZSPBDZ-UHFFFAOYSA-N | InChI=1S/C13H17N3O4S/c1-9(2)16-12(8-17)13(20-15-16)14-21(18,19)11-6-4-10(3)5-7-11/h4-7,9,17H,8H2,1-3H3 | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)CO | |
| AKOS005252841 | 307.371 | C13 H17 N5 O2 S | QGCSCCPWDUZMEQ-UHFFFAOYSA-N | InChI=1S/C13H17N5O2S/c1-8(2)18-6-12(20-17-18)16-11(19)7-21-13-14-9(3)5-10(4)15-13/h5-6,8H,7H2,1-4H3 | Cc1cc(nc(n1)SCC(=O)[N-]c2c[n+](no2)C(C)C)C | |
| AKOS005253419 | 323.371 | C13 H17 N5 O3 S | YFNUSYUXXQUJDA-UHFFFAOYSA-N | InChI=1S/C13H17N5O3S/c1-9-6-10(2)15-13(14-9)22-8-11(19)16-12-7-18(17-21-12)4-5-20-3/h6-7H,4-5,8H2,1-3H3 | Cc1cc(nc(n1)SCC(=O)[N-]c2c[n+](no2)CCOC)C | |
| AKOS005214802 | 262.308 | C13 H18 N4 O2 | QTTOMJIJDLQVJK-UHFFFAOYSA-N | InChI=1S/C13H18N4O2/c1-16(2)9-8-14-10-12-13(18)19-15-17(12)11-6-4-3-5-7-11/h3-7,14H,8-10H2,1-2H3 | CN(C)CCNCc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005252795 | 294.373 | C13 H18 N4 O2 S | NCKGUSGMUFNHSD-UHFFFAOYSA-N | InChI=1S/C13H18N4O2S/c1-9(2)17-7-13(19-16-17)15-12(18)8-20-11-5-3-10(14)4-6-11/h3,5,7,9H,4,6,8,14H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=CC=C(CC2)N | |
| AKOS005253375 | 310.372 | C13 H18 N4 O3 S | DJASIRJFKOABKG-UHFFFAOYSA-N | InChI=1S/C13H18N4O3S/c1-19-7-6-17-8-13(20-16-17)15-12(18)9-21-11-4-2-10(14)3-5-11/h2,4,8H,3,5-7,9,14H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSC2=CC=C(CC2)N | |
| AKOS005253138 | 322.386 | C13 H18 N6 O2 S | BYWGKXJPZRDENS-UHFFFAOYSA-N | InChI=1S/C13H18N6O2S/c1-17-8-5-14-13(17)22-10-11(20)15-12-9-19(16-21-12)18-6-3-2-4-7-18/h5,8-9H,2-4,6-7,10H2,1H3 | Cn1ccnc1SCC(=O)[N-]c2c[n+](no2)N3CCCCC3 | |
| AKOS005253149 | 350.399 | C13 H18 N8 O2 S | KHXFJSYEQYKGNA-UHFFFAOYSA-N | InChI=1S/C13H18N8O2S/c14-9-6-10(15)17-13(16-9)24-8-11(22)18-12-7-21(19-23-12)20-4-2-1-3-5-20/h6-7H,1-5,8H2,(H4-,14,15,16,17,18,19,22) | c1c(nc(nc1N)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3)N | |
| AKOS005214889 | 265.308 | C13 H19 N3 O3 | MVRSVAIGVHSLRL-UHFFFAOYSA-N | InChI=1S/C13H19N3O3/c1-9(17)12-13(14-10(2)18)19-15-16(12)11-7-5-3-4-6-8-11/h11H,3-8H2,1-2H3 | CC(=O)c1c(on[n+]1C2CCCCCC2)[N-]C(=O)C | |
| AKOS005219562 | 329.438 | C13 H19 N3 O3 S2 | RAIVBJRVJXXFCL-UHFFFAOYSA-N | InChI=1S/C13H19N3O3S2/c1-8-5-4-6-9(2)16(8)13(20)21-7-10(17)11-12(18)19-14-15(11)3/h8-9H,4-7H2,1-3H3 | CC1CCCC(N1C(=S)SCC(=O)c2c(on[n+]2C)[O-])C | |
| AKOS005215607 | 325.387 | C13 H19 N5 O3 S | NNAIHQQIJHTFLQ-UHFFFAOYSA-N | InChI=1S/C13H19N5O3S/c1-10-5-7-11(8-6-10)22(19,20)15-13-12(9-14-2)18(16-21-13)17(3)4/h5-8,14H,9H2,1-4H3 | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)N(C)C)CNC | |
| AKOS005252848 | 283.39 | C13 H21 N3 O2 S | AGTMNQQLWVIKBL-UHFFFAOYSA-N | InChI=1S/C13H21N3O2S/c1-10(2)16-8-13(18-15-16)14-12(17)9-19-11-6-4-3-5-7-11/h8,10-11H,3-7,9H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2CCCCC2 | |
| AKOS005215027 | 267.324 | C13 H21 N3 O3 | XBVWTUBKGKUXNX-UHFFFAOYSA-N | InChI=1S/C13H21N3O3/c1-9(17)12-13(14-10(2)18)19-15-16(12)11-7-5-3-4-6-8-11/h9,11,17H,3-8H2,1-2H3 | CC(c1c(on[n+]1C2CCCCCC2)[N-]C(=O)C)O | |
| AKOS005215592 | 267.324 | C13 H21 N3 O3 | BQQZZTOAWAPXRA-UHFFFAOYSA-N | InChI=1S/C13H21N3O3/c1-13(2,3)18-12(17)14-11-9-16(15-19-11)10-7-5-4-6-8-10/h9-10H,4-8H2,1-3H3 | CC(C)(C)OC(=O)[N-]c1c[n+](no1)C2CCCCC2 | |
| AKOS005253420 | 299.389 | C13 H21 N3 O3 S | AHXJJLRMOANOJK-UHFFFAOYSA-N | InChI=1S/C13H21N3O3S/c1-18-8-7-16-9-13(19-15-16)14-12(17)10-20-11-5-3-2-4-6-11/h9,11H,2-8,10H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSC2CCCCC2 | |
| AKOS005214944 | 266.339 | C13 H22 N4 O2 | UUOOJNZBITXDCL-UHFFFAOYSA-N | InChI=1S/C13H22N4O2/c1-10(18)15-13-12(9-14-2)17(16-19-13)11-7-5-3-4-6-8-11/h11,14H,3-9H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)C2CCCCCC2)CNC | |
| AKOS005215642 | 298.338 | C13 H22 N4 O4 | ZZUDEENKRNEMMF-UHFFFAOYSA-N | InChI=1S/C13H22N4O4/c1-13(2,3)20-12(18)14-11-10-17(15-21-11)5-4-16-6-8-19-9-7-16/h10H,4-9H2,1-3H3 | CC(C)(C)OC(=O)[N-]c1c[n+](no1)CCN2CCOCC2 | |
| AKOS005214180 | 253.341 | C13 H23 N3 O2 | USYSFELJFRYCRS-UHFFFAOYSA-N | InChI=1S/C13H23N3O2/c1-10(2)16-12(13(17)18-15-16)9-14-11-7-5-3-4-6-8-11/h10-11,14H,3-9H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNC2CCCCCC2 | |
| AKOS005251458 | 419.275 | C13 H8 F7 N3 O3 S | VPEDXTDAWVWREP-UHFFFAOYSA-N | InChI=1S/C13H8F7N3O3S/c1-3(27-11-12(25)26-22-23(11)2)10(24)21-9-7(16)5(14)4(13(18,19)20)6(15)8(9)17/h3H,1-2H3,(H-,21,22,24,25) | CC(C(=O)Nc1c(c(c(c(c1F)F)C(F)(F)F)F)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005252383 | 419.275 | C13 H8 F7 N3 O3 S | GYPZXKRFALOOST-UHFFFAOYSA-N | InChI=1S/C13H8F7N3O3S/c1-23-11(12(25)26-22-23)27-3-2-4(24)21-10-8(16)6(14)5(13(18,19)20)7(15)9(10)17/h2-3H2,1H3,(H-,21,22,24,25) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2c(c(c(c(c2F)F)C(F)(F)F)F)F | |
| AKOS005250111 | 268.228 | C13 H8 N4 O3 | QSPLAOJPXPLAQB-UHFFFAOYSA-N | InChI=1S/C13H8N4O3/c1-19-11-4-2-10(3-5-11)17-12(13(18)20-16-17)6-9(7-14)8-15/h2-6H,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C=C(C#N)C#N | |
| AKOS005219836 | 316.292 | C13 H8 N4 O4 S | VVQAGYFVQXDJHQ-UHFFFAOYSA-N | InChI=1S/C13H8N4O4S/c18-10-8(11(19)15-13(22)14-10)6-9-12(20)21-16-17(9)7-4-2-1-3-5-7/h1-6H,(H2-,14,15,16,18,19,20,22) | c1ccc(cc1)[n+]2c(c(on2)[O-])/C=C\3/C(=O)NC(=NC3=O)S | |
| AKOS005215609 | 347.677 | C13 H9 Cl F3 N3 O3 | ZDYZOZPHIFGQCM-UHFFFAOYSA-N | InChI=1S/C13H9ClF3N3O3/c1-2-20-9(10(21)7-4-3-5-8(14)6-7)11(23-19-20)18-12(22)13(15,16)17/h3-6H,2H2,1H3 | CC[n+]1c(c(on1)[N-]C(=O)C(F)(F)F)C(=O)c2cccc(c2)Cl | |
| AKOS005250712 | 358.296 | C13 H9 F3 N4 O3 S | POKDJAUFTILDAQ-UHFFFAOYSA-N | InChI=1S/C13H9F3N4O3S/c1-6-3-8(13(14,15)16)7(4-17)11(18-6)24-5-9(21)10-12(22)23-19-20(10)2/h3H,5H2,1-2H3 | Cc1cc(c(c(n1)SCC(=O)c2c(on[n+]2C)[O-])C#N)C(F)(F)F | |
| AKOS005250713 | 358.296 | C13 H9 F3 N4 O3 S | XUIYHNXOFAHGHA-UHFFFAOYSA-N | InChI=1S/C13H9F3N4O3S/c1-6-3-9(13(14,15)16)18-11(7(6)4-17)24-5-8(21)10-12(22)23-19-20(10)2/h3H,5H2,1-2H3 | Cc1cc(nc(c1C#N)SCC(=O)c2c(on[n+]2C)[O-])C(F)(F)F | |
| AKOS005253871 | 358.296 | C13 H9 F3 N4 O3 S | VGKPNWRZRRDPMA-UHFFFAOYSA-N | InChI=1S/C13H9F3N4O3S/c1-4-3-5(13(14,15)16)18-11-6(4)7(17)10(24-11)9(21)8-12(22)23-19-20(8)2/h3H,1-2H3,(H2-,17,19,21,22) | Cc1cc(nc2c1c(c(s2)C(=O)c3c(on[n+]3C)[O-])N)C(F)(F)F | |
| AKOS005219737 | 271.228 | C13 H9 N3 O4 | UXUKPPJZRRBCHD-UHFFFAOYSA-N | InChI=1S/C13H9N3O4/c1-16-10(13(18)20-15-16)7-9-12(17)19-11(14-9)8-5-3-2-4-6-8/h2-7H,1H3 | C[n+]1c(c(on1)[O-])/C=C\2/C(=O)OC(=N2)c3ccccc3 | |
| AKOS005219783 | 271.228 | C13 H9 N3 O4 | KCYXODQUJCOTPN-UHFFFAOYSA-N | InChI=1S/C13H9N3O4/c1-8-10(12(17)19-14-8)7-11-13(18)20-15-16(11)9-5-3-2-4-6-9/h2-7H,1H3 | CC\1=NOC(=O)/C1=C/c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250988 | 367.83 | C14 H10 Cl N3 O3 S2 | DIQJQWQGCTWZRB-UHFFFAOYSA-N | InChI=1S/C14H10ClN3O3S2/c1-18-12(13(20)21-17-18)11(19)7-23-14-16-10(6-22-14)8-2-4-9(15)5-3-8/h2-6H,7H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2nc(cs2)c3ccc(cc3)Cl | |
| AKOS005252005 | 433.301 | C14 H10 F7 N3 O3 S | ANHQWFUYVOIXHA-UHFFFAOYSA-N | InChI=1S/C14H10F7N3O3S/c1-3-4(28-12-13(26)27-23-24(12)2)11(25)22-10-8(17)6(15)5(14(19,20)21)7(16)9(10)18/h4H,3H2,1-2H3,(H-,22,23,25,26) | CCC(C(=O)Nc1c(c(c(c(c1F)F)C(F)(F)F)F)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005219519 | 314.319 | C14 H10 N4 O3 S | WMVNGRKCDKOJOZ-UHFFFAOYSA-N | InChI=1S/C14H10N4O3S/c19-11(9-22-14-15-7-4-8-16-14)12-13(20)21-17-18(12)10-5-2-1-3-6-10/h1-8H,9H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3ncccn3 | |
| AKOS005219723 | 346.318 | C14 H10 N4 O5 S | DRPYSMDSRSPBDW-UHFFFAOYSA-N | InChI=1S/C14H10N4O5S/c1-22-8-4-2-7(3-5-8)18-10(13(21)23-17-18)6-9-11(19)15-14(24)16-12(9)20/h2-6H,1H3,(H2-,15,16,17,19,20,21,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C\3/C(=O)NC(=NC3=O)S | |
| AKOS005250791 | 346.318 | C14 H10 N4 O5 S | MKDLGHLEMJNWGY-UHFFFAOYSA-N | InChI=1S/C14H10N4O5S/c19-9(7-24-14-15-10(20)6-11(21)16-14)12-13(22)23-17-18(12)8-4-2-1-3-5-8/h1-6H,7H2,(H2-,15,16,17,19,20,21,22) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nc(cc(n3)O)O | |
| AKOS005250710 | 342.333 | C14 H10 N6 O3 S | IEJKBRHAVJWKNV-UHFFFAOYSA-N | InChI=1S/C14H10N6O3S/c1-20-11(13(22)23-19-20)9(21)6-24-14-16-12-10(17-18-14)7-4-2-3-5-8(7)15-12/h2-5H,6H2,1H3,(H-,15,16,17,18,19,21,22) | C[n+]1c(c(on1)[O-])C(=O)CSc2nc3c(c4ccccc4[nH]3)nn2 | |
| AKOS005252479 | 366.846 | C14 H11 Cl N4 O2 S2 | FVWNVFNIKBEQFM-UHFFFAOYSA-N | InChI=1S/C14H11ClN4O2S2/c1-19-6-13(21-18-19)17-12(20)8-23-14-16-11(7-22-14)9-2-4-10(15)5-3-9/h2-7H,8H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2nc(cs2)c3ccc(cc3)Cl | |
| AKOS005250518 | 269.255 | C14 H11 N3 O3 | FYKQNZUFIUQIKK-UHFFFAOYSA-N | InChI=1S/C14H11N3O3/c1-17-12(14(19)20-16-17)13(18)15-11-7-6-9-4-2-3-5-10(9)8-11/h2-8H,1H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc3ccccc3c2 | |
| AKOS005250519 | 269.255 | C14 H11 N3 O3 | NEEGYDPFVRXVBC-UHFFFAOYSA-N | InChI=1S/C14H11N3O3/c1-17-12(14(19)20-16-17)13(18)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])C(=O)Nc2cccc3c2cccc3 | |
| AKOS005250986 | 333.385 | C14 H11 N3 O3 S2 | YUUXQCNAHKJBCF-UHFFFAOYSA-N | InChI=1S/C14H11N3O3S2/c1-17-12(13(19)20-16-17)11(18)8-22-14-15-10(7-21-14)9-5-3-2-4-6-9/h2-7H,8H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2nc(cs2)c3ccccc3 | |
| AKOS005219820 | 285.255 | C14 H11 N3 O4 | KYUWYRWGQUFWTQ-UHFFFAOYSA-N | InChI=1S/C14H11N3O4/c1-2-20-13(18)10(9-15)8-12-14(19)21-16-17(12)11-6-4-3-5-7-11/h3-8H,2H2,1H3 | CCOC(=O)/C(=C/c1c(on[n+]1c2ccccc2)[O-])/C#N | |
| AKOS005250114 | 301.254 | C14 H11 N3 O5 | QWYNVNRHLQRJRR-UHFFFAOYSA-N | InChI=1S/C14H11N3O5/c1-8-11(13(18)21-15-8)7-12-14(19)22-16-17(12)9-3-5-10(20-2)6-4-9/h3-7H,1-2H3 | CC\1=NOC(=O)/C1=C/c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252618 | 341.348 | C14 H11 N7 O2 S | VRYSNJOJNFISGQ-UHFFFAOYSA-N | InChI=1S/C14H11N7O2S/c1-21-6-11(23-20-21)16-10(22)7-24-14-17-13-12(18-19-14)8-4-2-3-5-9(8)15-13/h2-6H,7H2,1H3,(H-,15,16,17,18,19,20,22) | C[n+]1cc(on1)[N-]C(=O)CSc2nc3c(c4ccccc4[nH]3)nn2 | |
| AKOS005219465 | 311.259 | C14 H12 F3 N3 O2 | CNXSFLFBAITBPC-VMPITWQZSA-N | InChI=1S/C14H12F3N3O2/c1-2-20-9-13(22-19-20)18-12(21)8-5-10-3-6-11(7-4-10)14(15,16)17/h3-9H,2H2,1H3/b8-5+ | CC[n+]1cc(on1)[N-]C(=O)/C=C/c2ccc(cc2)C(F)(F)F | |
| AKOS005250331 | 327.259 | C14 H12 F3 N3 O3 | NABWSJUQPMZCHI-UHFFFAOYSA-N | InChI=1S/C14H12F3N3O3/c15-14(16,17)13(22)19(9-6-7-9)8-11-12(21)23-18-20(11)10-4-2-1-3-5-10/h1-5,9H,6-8H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)C(F)(F)F | |
| AKOS005252439 | 371.338 | C14 H12 F3 N5 O2 S | SBBFDVZOEFHLHO-UHFFFAOYSA-N | InChI=1S/C14H12F3N5O2S/c1-3-22-6-12(24-21-22)20-11(23)7-25-13-9(5-18)10(14(15,16)17)4-8(2)19-13/h4,6H,3,7H2,1-2H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)C)C(F)(F)F)C#N | |
| AKOS005252473 | 371.338 | C14 H12 F3 N5 O2 S | DJFGNDNAZIVDSA-UHFFFAOYSA-N | InChI=1S/C14H12F3N5O2S/c1-3-22-6-12(24-21-22)20-11(23)7-25-13-9(5-18)8(2)4-10(19-13)14(15,16)17/h4,6H,3,7H2,1-2H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)C(F)(F)F)C)C#N | |
| AKOS005252477 | 332.401 | C14 H12 N4 O2 S2 | JFSZUAREDGJKNG-UHFFFAOYSA-N | InChI=1S/C14H12N4O2S2/c1-18-7-13(20-17-18)16-12(19)9-22-14-15-11(8-21-14)10-5-3-2-4-6-10/h2-8H,9H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2nc(cs2)c3ccccc3 | |
| AKOS005219518 | 316.335 | C14 H12 N4 O3 S | JIDGUTUBCOUSAC-UHFFFAOYSA-N | InChI=1S/C14H12N4O3S/c1-17-8-7-15-14(17)22-9-11(19)12-13(20)21-16-18(12)10-5-3-2-4-6-10/h2-8H,9H2,1H3 | Cn1ccnc1SCC(=O)c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005219528 | 316.335 | C14 H12 N4 O3 S | PIRQIVGKUSDYQJ-UHFFFAOYSA-N | InChI=1S/C14H12N4O3S/c1-18-12(14(20)21-17-18)11(19)7-22-13-9(6-15)5-8-3-2-4-10(8)16-13/h5H,2-4,7H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2c(cc3c(n2)CCC3)C#N | |
| AKOS005251128 | 316.335 | C14 H12 N4 O3 S | AFYOEDSNBJPCFJ-UHFFFAOYSA-N | InChI=1S/C14H12N4O3S/c1-18-13(14(20)21-17-18)22-8-12(19)16-11-6-2-5-10-9(11)4-3-7-15-10/h2-7H,8H2,1H3,(H-,15,16,17,19,20) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2cccc3c2cccn3 | |
| AKOS005253874 | 316.335 | C14 H12 N4 O3 S | XAEGSWFCWIGLHS-UHFFFAOYSA-N | InChI=1S/C14H12N4O3S/c1-18-10(14(20)21-17-18)11(19)12-9(15)7-5-6-3-2-4-8(6)16-13(7)22-12/h5H,2-4H2,1H3,(H2-,15,17,19,20) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3cc4c(nc3s2)CCC4)N | |
| AKOS005250695 | 332.334 | C14 H12 N4 O4 S | LYWWSMUDWDUAMV-UHFFFAOYSA-N | InChI=1S/C14H12N4O4S/c1-17-12(20)8-5-3-4-6-9(8)15-14(17)23-7-10(19)11-13(21)22-16-18(11)2/h3-6H,7H2,1-2H3 | Cn1c(=O)c2ccccc2nc1SCC(=O)c3c(on[n+]3C)[O-] | |
| AKOS005250403 | 364.399 | C14 H12 N4 O4 S2 | QDGSVVLRGBYCSV-UHFFFAOYSA-N | InChI=1S/C14H12N4O4S2/c1-8-15-16-14(24-8)23-7-11(19)12-13(20)22-17-18(12)9-3-5-10(21-2)6-4-9/h3-6H,7H2,1-2H3 | Cc1nnc(s1)SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250790 | 344.348 | C14 H12 N6 O3 S | BPUXLUYSRVBRFW-UHFFFAOYSA-N | InChI=1S/C14H12N6O3S/c15-10-6-11(16)18-14(17-10)24-7-9(21)12-13(22)23-19-20(12)8-4-2-1-3-5-8/h1-6H,7H2,(H4-,15,16,17,18,19,21,22) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nc(cc(n3)N)N | |
| AKOS005250400 | 360.348 | C14 H12 N6 O4 S | VYQDWGLYUAFURH-UHFFFAOYSA-N | InChI=1S/C14H12N6O4S/c1-23-9-4-2-8(3-5-9)20-11(12(22)24-19-20)10(21)6-25-14-17-7-16-13(15)18-14/h2-5,7H,6H2,1H3,(H2-,15,16,17,18,19,21,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3ncnc(n3)N | |
| AKOS005253272 | 381.181 | C14 H13 Br N4 O4 | ORTRNMNRNPSKGA-UHFFFAOYSA-N | InChI=1S/C14H13BrN4O4/c1-18-11(14(22)23-17-18)7-16-10-6-12(20)19(13(10)21)9-4-2-8(15)3-5-9/h2-5,10,16H,6-7H2,1H3 | C[n+]1c(c(on1)[O-])CNC2CC(=O)N(C2=O)c3ccc(cc3)Br | |
| AKOS005252033 | 395.785 | C14 H13 Cl F3 N3 O3 S | DPVJPTKSLLNIOP-UHFFFAOYSA-N | InChI=1S/C14H13ClF3N3O3S/c1-3-10(25-12-13(23)24-20-21(12)2)11(22)19-9-5-4-7(15)6-8(9)14(16,17)18/h4-6,10H,3H2,1-2H3,(H-,19,20,22,23) | CCC(C(=O)Nc1ccc(cc1C(F)(F)F)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005252036 | 395.785 | C14 H13 Cl F3 N3 O3 S | SLAQWMKNAGRSKZ-UHFFFAOYSA-N | InChI=1S/C14H13ClF3N3O3S/c1-3-10(25-12-13(23)24-20-21(12)2)11(22)19-9-6-7(14(16,17)18)4-5-8(9)15/h4-6,10H,3H2,1-2H3,(H-,19,20,22,23) | CCC(C(=O)Nc1cc(ccc1Cl)C(F)(F)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005253265 | 336.73 | C14 H13 Cl N4 O4 | ZFQYBLCLSZOIOC-UHFFFAOYSA-N | InChI=1S/C14H13ClN4O4/c1-18-11(14(22)23-17-18)7-16-10-6-12(20)19(13(10)21)9-4-2-8(15)3-5-9/h2-5,10,16H,6-7H2,1H3 | C[n+]1c(c(on1)[O-])CNC2CC(=O)N(C2=O)c3ccc(cc3)Cl | |
| AKOS005253274 | 320.276 | C14 H13 F N4 O4 | UNAFOEYVEYBEHT-UHFFFAOYSA-N | InChI=1S/C14H13FN4O4/c1-18-11(14(22)23-17-18)7-16-10-6-12(20)19(13(10)21)9-4-2-8(15)3-5-9/h2-5,10,16H,6-7H2,1H3 | C[n+]1c(c(on1)[O-])CNC2CC(=O)N(C2=O)c3ccc(cc3)F | |
| AKOS005252759 | 386.352 | C14 H13 F3 N6 O2 S | AARLXIGEKCZLIG-UHFFFAOYSA-N | InChI=1S/C14H13F3N6O2S/c1-8-4-10(14(15,16)17)9(5-18)13(19-8)26-7-11(24)20-12-6-23(21-25-12)22(2)3/h4,6H,7H2,1-3H3 | Cc1cc(c(c(n1)SCC(=O)[N-]c2c[n+](no2)N(C)C)C#N)C(F)(F)F | |
| AKOS005252760 | 386.352 | C14 H13 F3 N6 O2 S | ZRXXZPVDIJSBJC-UHFFFAOYSA-N | InChI=1S/C14H13F3N6O2S/c1-8-4-10(14(15,16)17)19-13(9(8)5-18)26-7-11(24)20-12-6-23(21-25-12)22(2)3/h4,6H,7H2,1-3H3 | Cc1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)N(C)C)C(F)(F)F | |
| AKOS005253273 | 428.182 | C14 H13 I N4 O4 | ZFQHFMQEPMNQBU-UHFFFAOYSA-N | InChI=1S/C14H13IN4O4/c1-18-11(14(22)23-17-18)7-16-10-6-12(20)19(13(10)21)9-4-2-8(15)3-5-9/h2-5,10,16H,6-7H2,1H3 | C[n+]1c(c(on1)[O-])CNC2CC(=O)N(C2=O)c3ccc(cc3)I | |
| AKOS005214196 | 287.337 | C14 H13 N3 O2 S | BHMJUAYTZOTNFD-UHFFFAOYSA-N | InChI=1S/C14H13N3O2S/c18-14-13(10-15-9-12-7-4-8-20-12)17(16-19-14)11-5-2-1-3-6-11/h1-8,15H,9-10H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3cccs3 | |
| AKOS005219451 | 287.337 | C14 H13 N3 O2 S | DISKNUSWWOEKPF-UHFFFAOYSA-N | InChI=1S/C14H13N3O2S/c18-14-13(9-15-8-11-6-7-20-10-11)17(16-19-14)12-4-2-1-3-5-12/h1-7,10,15H,8-9H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3ccsc3 | |
| AKOS005215596 | 323.798 | C14 H13 N3 O2 S . Cl H | QFNHWDBECXIGCP-UHFFFAOYSA-N | InChI=1S/C14H13N3O2S.ClH/c18-14-13(9-15-8-11-6-7-20-10-11)17(16-19-14)12-4-2-1-3-5-12;/h1-7,10,15H,8-9H2;1H | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3ccsc3.Cl | |
| AKOS005214170 | 271.271 | C14 H13 N3 O3 | XIPZXWZRWWBGSX-UHFFFAOYSA-N | InChI=1S/C14H13N3O3/c18-14-13(10-15-9-12-7-4-8-19-12)17(16-20-14)11-5-2-1-3-6-11/h1-8,15H,9-10H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3ccco3 | |
| AKOS005219493 | 351.401 | C14 H13 N3 O4 S2 | UECIWPUFXZVAOG-UHFFFAOYSA-N | InChI=1S/C14H13N3O4S2/c1-20-10-4-2-9(3-5-10)17-12(13(19)21-16-17)11(18)8-23-14-15-6-7-22-14/h2-5H,6-8H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=NCCS3 | |
| AKOS005252516 | 315.35 | C14 H13 N5 O2 S | JUNFJMPELOXWQK-UHFFFAOYSA-N | InChI=1S/C14H13N5O2S/c1-19-7-13(21-18-19)17-12(20)8-22-14-10(6-15)5-9-3-2-4-11(9)16-14/h5,7H,2-4,8H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCC3)C#N | |
| AKOS005252628 | 331.35 | C14 H13 N5 O3 S | KOSLHQHXAHTWPB-UHFFFAOYSA-N | InChI=1S/C14H13N5O3S/c1-18-7-12(22-17-18)16-11(20)8-23-14-15-10-6-4-3-5-9(10)13(21)19(14)2/h3-7H,8H2,1-2H3 | Cn1c(=O)c2ccccc2nc1SCC(=O)[N-]c3c[n+](no3)C | |
| AKOS005250600 | 347.349 | C14 H13 N5 O4 S | VGGGUKUTKAYHSV-UHFFFAOYSA-N | InChI=1S/C14H13N5O4S/c1-7(20)19-4-3-8-9(5-15)13(24-10(8)6-19)16-12(21)11-14(22)23-17-18(11)2/h3-4,6H2,1-2H3,(H-,16,17,21,22) | CC(=O)N1CCc2c(sc(c2C#N)NC(=O)c3c(on[n+]3C)[O-])C1 | |
| AKOS005253378 | 347.283 | C14 H13 N5 O6 | YRYPMNWARHMKBE-UHFFFAOYSA-N | InChI=1S/C14H13N5O6/c1-17-11(14(22)25-16-17)7-15-10-6-12(20)18(13(10)21)8-2-4-9(5-3-8)19(23)24/h2-5,10,15H,6-7H2,1H3 | C[n+]1c(c(on1)[O-])CNC2CC(=O)N(C2=O)c3ccc(cc3)N(=O)=O | |
| AKOS005251999 | 371.796 | C14 H14 Cl N3 O5 S | XYQVFZVQSWWLBG-UHFFFAOYSA-N | InChI=1S/C14H14ClN3O5S/c1-3-10(24-12-14(22)23-17-18(12)2)11(19)16-9-6-7(13(20)21)4-5-8(9)15/h4-6,10H,3H2,1-2H3,(H2-,16,17,19,20,21,22) | CCC(C(=O)Nc1cc(ccc1Cl)C(=O)O)Sc2c(on[n+]2C)[O-] | |
| AKOS005252058 | 371.796 | C14 H14 Cl N3 O5 S | GRRSVTYTPJANTJ-UHFFFAOYSA-N | InChI=1S/C14H14ClN3O5S/c1-3-10(24-12-14(22)23-17-18(12)2)11(19)16-7-4-5-9(15)8(6-7)13(20)21/h4-6,10H,3H2,1-2H3,(H2-,16,17,19,20,21,22) | CCC(C(=O)Nc1ccc(c(c1)C(=O)O)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005251700 | 361.339 | C14 H14 F3 N3 O3 S | OCWYNTFFTRWXKQ-UHFFFAOYSA-N | InChI=1S/C14H14F3N3O3S/c1-3-10(24-12-13(22)23-19-20(12)2)11(21)18-9-7-5-4-6-8(9)14(15,16)17/h4-7,10H,3H2,1-2H3,(H-,18,19,21,22) | CCC(C(=O)Nc1ccccc1C(F)(F)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005251709 | 361.339 | C14 H14 F3 N3 O3 S | LFWJZKSLWZKEFS-UHFFFAOYSA-N | InChI=1S/C14H14F3N3O3S/c1-3-10(24-12-13(22)23-19-20(12)2)11(21)18-9-6-4-5-8(7-9)14(15,16)17/h4-7,10H,3H2,1-2H3,(H-,18,19,21,22) | CCC(C(=O)Nc1cccc(c1)C(F)(F)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005251943 | 377.339 | C14 H14 F3 N3 O4 S | DHFGCYSRQPIXCX-UHFFFAOYSA-N | InChI=1S/C14H14F3N3O4S/c1-3-10(25-12-13(22)24-19-20(12)2)11(21)18-8-4-6-9(7-5-8)23-14(15,16)17/h4-7,10H,3H2,1-2H3,(H-,18,19,21,22) | CCC(C(=O)Nc1ccc(cc1)OC(F)(F)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005251957 | 377.339 | C14 H14 F3 N3 O4 S | VPMOVGZMXRKZFW-UHFFFAOYSA-N | InChI=1S/C14H14F3N3O4S/c1-3-10(25-12-13(22)24-19-20(12)2)11(21)18-8-6-4-5-7-9(8)23-14(15,16)17/h4-7,10H,3H2,1-2H3,(H-,18,19,21,22) | CCC(C(=O)Nc1ccccc1OC(F)(F)F)Sc2c(on[n+]2C)[O-] | |
| AKOS005219559 | 322.336 | C14 H14 N2 O5 S | JRZJVPQQLWKPCR-UHFFFAOYSA-N | InChI=1S/C14H14N2O5S/c1-2-20-12(18)9-22-8-11(17)13-14(19)21-15-16(13)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3 | CCOC(=O)CSCC(=O)c1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005251331 | 322.336 | C14 H14 N2 O5 S | KAUMEDKZZBHAFG-UHFFFAOYSA-N | InChI=1S/C14H14N2O5S/c1-2-20-12(18)8-11(17)9-22-13-14(19)21-15-16(13)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3 | CCOC(=O)CC(=O)CSc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005219529 | 318.351 | C14 H14 N4 O3 S | ZOCYJRPRHFZLEL-UHFFFAOYSA-N | InChI=1S/C14H14N4O3S/c1-8(2)10-5-4-9(6-15)13(16-10)22-7-11(19)12-14(20)21-17-18(12)3/h4-5,8H,7H2,1-3H3 | CC(C)c1ccc(c(n1)SCC(=O)c2c(on[n+]2C)[O-])C#N | |
| AKOS005219531 | 318.351 | C14 H14 N4 O3 S | MCHWTHDRLPAMHS-UHFFFAOYSA-N | InChI=1S/C14H14N4O3S/c1-3-4-10-6-5-9(7-15)13(16-10)22-8-11(19)12-14(20)21-17-18(12)2/h5-6H,3-4,8H2,1-2H3 | CCCc1ccc(c(n1)SCC(=O)c2c(on[n+]2C)[O-])C#N | |
| AKOS005250605 | 318.351 | C14 H14 N4 O3 S | IZSNXTMHXJDFHI-UHFFFAOYSA-N | InChI=1S/C14H14N4O3S/c1-7-3-4-8-9(6-15)13(22-10(8)5-7)16-12(19)11-14(20)21-17-18(11)2/h7H,3-5H2,1-2H3,(H-,16,17,19,20) | CC1CCc2c(sc(c2C#N)NC(=O)c3c(on[n+]3C)[O-])C1 | |
| AKOS005250747 | 318.351 | C14 H14 N4 O3 S | YLAFIZGVSUMPAK-UHFFFAOYSA-N | InChI=1S/C14H14N4O3S/c1-7-8(2)10(5-15)13(16-9(7)3)22-6-11(19)12-14(20)21-17-18(12)4/h6H2,1-4H3 | Cc1c(c(c(nc1C)SCC(=O)c2c(on[n+]2C)[O-])C#N)C | |
| AKOS005251505 | 318.351 | C14 H14 N4 O3 S | KTCOLHRTKXAJMM-UHFFFAOYSA-N | InChI=1S/C14H14N4O3S/c1-8(22-13-14(20)21-17-18(13)2)12(19)16-10-3-4-11-9(7-10)5-6-15-11/h3-8,17,20H,1-2H3 | CC(C(=O)Nc1ccc2c(c1)cc[nH]2)Sc3c(on[n+]3C)[O-] | |
| AKOS005252343 | 318.351 | C14 H14 N4 O3 S | KSOKPOULQVSJBB-UHFFFAOYSA-N | InChI=1S/C14H14N4O3S/c1-18-13(14(20)21-17-18)22-7-5-12(19)16-10-2-3-11-9(8-10)4-6-15-11/h2-4,6,8,17,20H,5,7H2,1H3 | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc3c(c2)cc[nH]3 | |
| AKOS005252828 | 318.351 | C14 H14 N4 O3 S | MSBCURBUAVYMFW-UHFFFAOYSA-N | InChI=1S/C14H14N4O3S/c1-9(2)18-7-13(21-17-18)16-12(19)8-22-14-15-10-5-3-4-6-11(10)20-14/h3-7,9H,8H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3o2 | |
| AKOS005253838 | 318.351 | C14 H14 N4 O3 S | GOKDPYBCNUSKDZ-UHFFFAOYSA-N | InChI=1S/C14H14N4O3S/c1-6(2)8-5-4-7-9(15)12(22-13(7)16-8)11(19)10-14(20)21-17-18(10)3/h4-6H,1-3H3,(H2-,15,17,19,20) | CC(C)c1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3C)[O-])N | |
| AKOS005253855 | 318.351 | C14 H14 N4 O3 S | QFOLNSDPBVYEII-UHFFFAOYSA-N | InChI=1S/C14H14N4O3S/c1-3-4-7-5-6-8-9(15)12(22-13(8)16-7)11(19)10-14(20)21-17-18(10)2/h5-6H,3-4H2,1-2H3,(H2-,15,17,19,20) | CCCc1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3C)[O-])N | |
| AKOS005253894 | 318.351 | C14 H14 N4 O3 S | BUQSFDJIGJNNFT-UHFFFAOYSA-N | InChI=1S/C14H14N4O3S/c1-5-6(2)8-9(15)12(22-13(8)16-7(5)3)11(19)10-14(20)21-17-18(10)4/h1-4H3,(H2-,15,17,19,20) | Cc1c(c2c(c(sc2nc1C)C(=O)c3c(on[n+]3C)[O-])N)C | |
| AKOS005251623 | 350.416 | C14 H14 N4 O3 S2 | YRDRVKVEITXJJE-UHFFFAOYSA-N | InChI=1S/C14H14N4O3S2/c1-18-13(14(20)21-17-18)22-7-11(19)16-12-9(6-15)8-4-2-3-5-10(8)23-12/h2-5,7H2,1H3,(H-,16,17,19,20) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2c(c3c(s2)CCCC3)C#N | |
| AKOS005253322 | 302.285 | C14 H14 N4 O4 | VWRQVVQWPRWKRL-UHFFFAOYSA-N | InChI=1S/C14H14N4O4/c1-17-11(14(21)22-16-17)8-15-10-7-12(19)18(13(10)20)9-5-3-2-4-6-9/h2-6,10,15H,7-8H2,1H3 | C[n+]1c(c(on1)[O-])CNC2CC(=O)N(C2=O)c3ccccc3 | |
| AKOS005253399 | 334.35 | C14 H14 N4 O4 S | FQEAZMWCNQWMEK-UHFFFAOYSA-N | InChI=1S/C14H14N4O4S/c1-20-7-6-18-8-13(22-17-18)16-12(19)9-23-14-15-10-4-2-3-5-11(10)21-14/h2-5,8H,6-7,9H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3o2 | |
| AKOS005253024 | 354.812 | C14 H15 Cl N4 O3 S | HCZZZXPFUYYINT-UHFFFAOYSA-N | InChI=1S/C14H15ClN4O3S/c15-11-1-3-12(4-2-11)23-10-13(20)16-14-9-19(17-22-14)18-5-7-21-8-6-18/h1-4,9H,5-8,10H2 | c1cc(ccc1SCC(=O)[N-]c2c[n+](no2)N3CCOCC3)Cl | |
| AKOS005215605 | 344.193 | C14 H15 Cl2 N3 O3 | JLVCNCWSDYHZJV-UHFFFAOYSA-N | InChI=1S/C14H15Cl2N3O3/c1-14(2,3)21-13(20)17-12-8-19(18-22-12)7-9-4-5-10(15)6-11(9)16/h4-6,8H,7H2,1-3H3 | CC(C)(C)OC(=O)[N-]c1c[n+](no1)Cc2ccc(cc2Cl)Cl | |
| AKOS005215672 | 344.289 | C14 H15 F3 N4 O3 | BGYIRENOFNRVNI-UHFFFAOYSA-N | InChI=1S/C14H15F3N4O3/c1-8(22)18-13-11(21(19-24-13)20(2)3)12(23)9-4-6-10(7-5-9)14(15,16)17/h4-7,12,23H,1-3H3 | CC(=O)[N-]c1c([n+](no1)N(C)C)C(c2ccc(cc2)C(F)(F)F)O | |
| AKOS005214907 | 273.287 | C14 H15 N3 O3 | WTJOCBLGKOBQOI-UHFFFAOYSA-N | InChI=1S/C14H15N3O3/c1-9-4-6-12(7-5-9)8-17-13(10(2)18)14(20-16-17)15-11(3)19/h4-7H,8H2,1-3H3 | Cc1ccc(cc1)C[n+]2c(c(on2)[N-]C(=O)C)C(=O)C | |
| AKOS005214923 | 273.287 | C14 H15 N3 O3 | PLLFMVZYUGKIQA-UHFFFAOYSA-N | InChI=1S/C14H15N3O3/c1-10(18)13-14(15-11(2)19)20-16-17(13)9-8-12-6-4-3-5-7-12/h3-7H,8-9H2,1-2H3 | CC(=O)c1c(on[n+]1CCc2ccccc2)[N-]C(=O)C | |
| AKOS005219489 | 273.287 | C14 H15 N3 O3 | BYCPLGYJJXNMIY-UHFFFAOYSA-N | InChI=1S/C14H15N3O3/c1-10(18)16(11-7-8-11)9-13-14(19)20-15-17(13)12-5-3-2-4-6-12/h2-6,11H,7-9H2,1H3 | CC(=O)N(Cc1c(on[n+]1c2ccccc2)[O-])C3CC3 | |
| AKOS005250373 | 273.287 | C14 H15 N3 O3 | SNCOXCCTRBJJIX-CMDGGOBGSA-N | InChI=1S/C14H15N3O3/c1-16(10-12-14(19)20-15-17(12)2)13(18)9-8-11-6-4-3-5-7-11/h3-9H,10H2,1-2H3/b9-8+ | C[n+]1c(c(on1)[O-])CN(C)C(=O)/C=C/c2ccccc2 | |
| AKOS005250378 | 273.287 | C14 H15 N3 O3 | HHVCLSAXTFMBGX-UHFFFAOYSA-N | InChI=1S/C14H15N3O3/c1-16(13(18)10-7-8-10)9-12-14(19)20-15-17(12)11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)C3CC3 | |
| AKOS005250388 | 273.287 | C14 H15 N3 O3 | NUWRJSBGKOKJTB-UHFFFAOYSA-N | InChI=1S/C14H15N3O3/c18-13(16-9-5-2-6-10-16)12-14(19)20-15-17(12)11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCCCC3 | |
| AKOS005219486 | 305.352 | C14 H15 N3 O3 S | BJNPZRFYUZBAHH-UHFFFAOYSA-N | InChI=1S/C14H15N3O3S/c1-10(2)17-12(8-18)14(20-16-17)15-13(19)9-21-11-6-4-3-5-7-11/h3-8,10H,9H2,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)CSc2ccccc2)C=O | |
| AKOS005214921 | 289.287 | C14 H15 N3 O4 | STKOEKRAMCNKDG-UHFFFAOYSA-N | InChI=1S/C14H15N3O4/c1-9(18)13-14(15-10(2)19)21-16-17(13)8-11-4-6-12(20-3)7-5-11/h4-7H,8H2,1-3H3 | CC(=O)c1c(on[n+]1Cc2ccc(cc2)OC)[N-]C(=O)C | |
| AKOS005215704 | 289.287 | C14 H15 N3 O4 | GPABBXZWASOLMC-UHFFFAOYSA-N | InChI=1S/C14H15N3O4/c1-10(19)15-14-12(9-18)17(16-21-14)8-7-11-5-3-4-6-13(11)20-2/h3-6,9H,7-8H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)CCc2ccccc2OC)C=O | |
| AKOS005250492 | 289.287 | C14 H15 N3 O4 | XZBRVJSPULDMBX-UHFFFAOYSA-N | InChI=1S/C14H15N3O4/c18-11-6-8-16(9-7-11)13(19)12-14(20)21-15-17(12)10-4-2-1-3-5-10/h1-5,11,18H,6-9H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCC(CC3)O | |
| AKOS005250545 | 289.287 | C14 H15 N3 O4 | FHUKDKUUQZPMCX-UHFFFAOYSA-N | InChI=1S/C14H15N3O4/c1-20-11-6-4-10(5-7-11)17-12(14(19)21-15-17)13(18)16-8-2-3-9-16/h4-7H,2-3,8-9H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCCC3 | |
| AKOS005219769 | 321.352 | C14 H15 N3 O4 S | ISSHWCFBCDSTJQ-UHFFFAOYSA-N | InChI=1S/C14H15N3O4S/c1-14(2)10(12(18)19)22-11(15-14)9-13(20)21-16-17(9)8-6-4-3-5-7-8/h3-7,10-11,15H,1-2H3,(H-,16,18,19,20) | CC1(C(SC(N1)c2c(on[n+]2c3ccccc3)[O-])C(=O)O)C | |
| AKOS005250574 | 321.352 | C14 H15 N3 O4 S | JKOYFBNJXZZUAA-UHFFFAOYSA-N | InChI=1S/C14H15N3O4S/c1-20-11-4-2-10(3-5-11)17-12(14(19)21-15-17)13(18)16-6-8-22-9-7-16/h2-5H,6-9H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCSCC3 | |
| AKOS005251454 | 321.352 | C14 H15 N3 O4 S | FSDZRVDMGJRTAD-UHFFFAOYSA-N | InChI=1S/C14H15N3O4S/c1-8(18)10-4-6-11(7-5-10)15-12(19)9(2)22-13-14(20)21-16-17(13)3/h4-7,9H,1-3H3,(H-,15,16,18,19,20) | CC(C(=O)Nc1ccc(cc1)C(=O)C)Sc2c(on[n+]2C)[O-] | |
| AKOS005252369 | 321.352 | C14 H15 N3 O4 S | PJLUFPNCZDPLOC-UHFFFAOYSA-N | InChI=1S/C14H15N3O4S/c1-9(18)10-3-5-11(6-4-10)15-12(19)7-8-22-13-14(20)21-16-17(13)2/h3-6H,7-8H2,1-2H3,(H-,15,16,18,19,20) | CC(=O)c1ccc(cc1)NC(=O)CCSc2c(on[n+]2C)[O-] | |
| AKOS005250546 | 305.286 | C14 H15 N3 O5 | DSPYMJLHPQBAFC-UHFFFAOYSA-N | InChI=1S/C14H15N3O5/c1-20-11-4-2-10(3-5-11)17-12(14(19)22-15-17)13(18)16-6-8-21-9-7-16/h2-5H,6-9H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCOCC3 | |
| AKOS005215490 | 337.351 | C14 H15 N3 O5 S | DYZYLVPYZQZNLW-UHFFFAOYSA-N | InChI=1S/C14H15N3O5S/c1-9(2)17-12(8-18)13(22-16-17)15-14(19)23(20,21)11-6-4-10(3)5-7-11/h4-9H,1-3H3 | Cc1ccc(cc1)S(=O)(=O)C(=O)[N-]c2c([n+](no2)C(C)C)C=O | |
| AKOS005250598 | 337.351 | C14 H15 N3 O5 S | UUUAUMCIINBZHH-UHFFFAOYSA-N | InChI=1S/C14H15N3O5S/c1-17-10(14(20)22-16-17)11(18)15-12-9(13(19)21-2)7-5-3-4-6-8(7)23-12/h3-6H2,1-2H3,(H-,15,16,18,19,20) | C[n+]1c(c(on1)[O-])C(=O)Nc2c(c3c(s2)CCCC3)C(=O)OC | |
| AKOS005251221 | 337.351 | C14 H15 N3 O5 S | ZIMLORYKMCNWEB-UHFFFAOYSA-N | InChI=1S/C14H15N3O5S/c1-3-21-13(19)9-4-6-10(7-5-9)15-11(18)8-23-12-14(20)22-16-17(12)2/h4-7H,3,8H2,1-2H3,(H-,15,16,18,19,20) | CCOC(=O)c1ccc(cc1)NC(=O)CSc2c(on[n+]2C)[O-] | |
| AKOS005251468 | 337.351 | C14 H15 N3 O5 S | RGRIKILKDOGQTC-UHFFFAOYSA-N | InChI=1S/C14H15N3O5S/c1-7-4-5-9(13(19)20)6-10(7)15-11(18)8(2)23-12-14(21)22-16-17(12)3/h4-6,8H,1-3H3,(H2-,15,16,18,19,20,21) | Cc1ccc(cc1NC(=O)C(C)Sc2c(on[n+]2C)[O-])C(=O)O | |
| AKOS005251486 | 337.351 | C14 H15 N3 O5 S | JPHPEAAHMLKJTF-UHFFFAOYSA-N | InChI=1S/C14H15N3O5S/c1-8(23-13-14(19)22-16-17(13)2)12(18)15-9-3-4-10-11(7-9)21-6-5-20-10/h3-4,7-8H,5-6H2,1-2H3,(H-,15,16,18,19) | CC(C(=O)Nc1ccc2c(c1)OCCO2)Sc3c(on[n+]3C)[O-] | |
| AKOS005251503 | 337.351 | C14 H15 N3 O5 S | VJIVCABXOLZKNH-UHFFFAOYSA-N | InChI=1S/C14H15N3O5S/c1-8(23-12-14(20)22-16-17(12)2)11(18)15-10-7-5-4-6-9(10)13(19)21-3/h4-8H,1-3H3,(H-,15,16,18,19,20) | CC(C(=O)Nc1ccccc1C(=O)OC)Sc2c(on[n+]2C)[O-] | |
| AKOS005251934 | 337.351 | C14 H15 N3 O5 S | UZVFEQGJQFVYPO-UHFFFAOYSA-N | InChI=1S/C14H15N3O5S/c1-3-11(23-13-14(19)22-16-17(13)2)12(18)15-8-4-5-9-10(6-8)21-7-20-9/h4-6,11H,3,7H2,1-2H3,(H-,15,16,18,19) | CCC(C(=O)Nc1ccc2c(c1)OCO2)Sc3c(on[n+]3C)[O-] | |
| AKOS005251993 | 337.351 | C14 H15 N3 O5 S | WTXADDFYRINRDV-UHFFFAOYSA-N | InChI=1S/C14H15N3O5S/c1-3-10(23-12-14(21)22-16-17(12)2)11(18)15-9-6-4-5-8(7-9)13(19)20/h4-7,10H,3H2,1-2H3,(H2-,15,16,18,19,20,21) | CCC(C(=O)Nc1cccc(c1)C(=O)O)Sc2c(on[n+]2C)[O-] | |
| AKOS005252008 | 337.351 | C14 H15 N3 O5 S | LGDOUROODAYBTK-UHFFFAOYSA-N | InChI=1S/C14H15N3O5S/c1-3-10(23-12-14(21)22-16-17(12)2)11(18)15-9-6-4-8(5-7-9)13(19)20/h4-7,10H,3H2,1-2H3,(H2-,15,16,18,19,20,21) | CCC(C(=O)Nc1ccc(cc1)C(=O)O)Sc2c(on[n+]2C)[O-] | |
| AKOS005252302 | 337.351 | C14 H15 N3 O5 S | YHKFNVYFTZSZAS-UHFFFAOYSA-N | InChI=1S/C14H15N3O5S/c1-8-3-4-9(13(19)20)7-10(8)15-11(18)5-6-23-12-14(21)22-16-17(12)2/h3-4,7H,5-6H2,1-2H3,(H2-,15,16,18,19,20,21) | Cc1ccc(cc1NC(=O)CCSc2c(on[n+]2C)[O-])C(=O)O | |
| AKOS005252322 | 337.351 | C14 H15 N3 O5 S | QFAUVFJLLDVELI-UHFFFAOYSA-N | InChI=1S/C14H15N3O5S/c1-17-13(14(19)22-16-17)23-7-4-12(18)15-9-2-3-10-11(8-9)21-6-5-20-10/h2-3,8H,4-7H2,1H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc3c(c2)OCCO3 | |
| AKOS005252330 | 337.351 | C14 H15 N3 O5 S | JIPRHPADIUQYLE-UHFFFAOYSA-N | InChI=1S/C14H15N3O5S/c1-17-12(14(20)22-16-17)23-8-7-11(18)15-10-6-4-3-5-9(10)13(19)21-2/h3-6H,7-8H2,1-2H3,(H-,15,16,18,19,20) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccccc2C(=O)OC | |
| AKOS005251507 | 353.35 | C14 H15 N3 O6 S | LMIXQIYUGMVULK-UHFFFAOYSA-N | InChI=1S/C14H15N3O6S/c1-7(24-12-14(21)23-16-17(12)2)11(18)15-9-5-4-8(13(19)20)6-10(9)22-3/h4-7H,1-3H3,(H2-,15,16,18,19,20,21) | CC(C(=O)Nc1ccc(cc1OC)C(=O)O)Sc2c(on[n+]2C)[O-] | |
| AKOS005251908 | 353.35 | C14 H15 N3 O6 S | AXEBVTIQAFUETO-UHFFFAOYSA-N | InChI=1S/C14H15N3O6S/c1-3-10(24-12-14(22)23-16-17(12)2)11(19)15-7-4-5-9(18)8(6-7)13(20)21/h4-6,10,16H,3H2,1-2H3,(H2,20,21,22) | CCC(C(=O)Nc1ccc(c(c1)C(=O)O)O)Sc2c(on[n+]2C)[O-] | |
| AKOS005252345 | 353.35 | C14 H15 N3 O6 S | QXLUSCSNDKHHHM-UHFFFAOYSA-N | InChI=1S/C14H15N3O6S/c1-17-12(14(21)23-16-17)24-6-5-11(18)15-9-4-3-8(13(19)20)7-10(9)22-2/h3-4,7H,5-6H2,1-2H3,(H2-,15,16,18,19,20,21) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2OC)C(=O)O | |
| AKOS005219557 | 317.366 | C14 H15 N5 O2 S | ZHVMQHWEOMMAGI-UHFFFAOYSA-N | InChI=1S/C14H15N5O2S/c1-9(2)19-7-13(21-18-19)17-12(20)8-22-14-11(6-15)5-4-10(3)16-14/h4-5,7,9H,8H2,1-3H3 | Cc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)C(C)C)C#N | |
| AKOS005252405 | 317.366 | C14 H15 N5 O2 S | XNUGJGPVTMUDQK-UHFFFAOYSA-N | InChI=1S/C14H15N5O2S/c1-8-9(2)11(5-15)14(16-10(8)3)22-7-12(20)17-13-6-19(4)18-21-13/h6H,7H2,1-4H3 | Cc1c(c(c(nc1C)SCC(=O)[N-]c2c[n+](no2)C)C#N)C | |
| AKOS005252507 | 317.366 | C14 H15 N5 O2 S | RAOLZUYDBQDKRZ-UHFFFAOYSA-N | InChI=1S/C14H15N5O2S/c1-4-19-7-13(21-18-19)17-12(20)8-22-14-11(6-15)9(2)5-10(3)16-14/h5,7H,4,8H2,1-3H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)C)C)C#N | |
| AKOS005252522 | 317.366 | C14 H15 N5 O2 S | QWUSUDUKSVKNRG-UHFFFAOYSA-N | InChI=1S/C14H15N5O2S/c1-9(2)11-5-4-10(6-15)14(16-11)22-8-12(20)17-13-7-19(3)18-21-13/h4-5,7,9H,8H2,1-3H3 | CC(C)c1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)C)C#N | |
| AKOS005252528 | 317.366 | C14 H15 N5 O2 S | AEVUYGRRCQSXOE-UHFFFAOYSA-N | InChI=1S/C14H15N5O2S/c1-3-4-11-6-5-10(7-15)14(16-11)22-9-12(20)17-13-8-19(2)18-21-13/h5-6,8H,3-4,9H2,1-2H3 | CCCc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)C)C#N | |
| AKOS005252831 | 317.366 | C14 H15 N5 O2 S | GIIWYPZGOKKZDG-UHFFFAOYSA-N | InChI=1S/C14H15N5O2S/c1-9(2)19-7-13(21-18-19)17-12(20)8-22-14-15-10-5-3-4-6-11(10)16-14/h3-7,9H,8H2,1-2H3,(H-,15,16,17,18,20) | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2[nH]c3ccccc3n2 | |
| AKOS005253400 | 333.366 | C14 H15 N5 O3 S | UNXPLYHZVIRBPU-UHFFFAOYSA-N | InChI=1S/C14H15N5O3S/c1-21-7-6-19-8-13(22-18-19)17-12(20)9-23-14-15-10-4-2-3-5-11(10)16-14/h2-5,8H,6-7,9H2,1H3,(H-,15,16,17,18,20) | COCC[n+]1cc(on1)[N-]C(=O)CSc2[nH]c3ccccc3n2 | |
| AKOS005253406 | 333.366 | C14 H15 N5 O3 S | JLWGKVNSMOVOOI-UHFFFAOYSA-N | InChI=1S/C14H15N5O3S/c1-10-3-4-11(7-15)14(16-10)23-9-12(20)17-13-8-19(18-22-13)5-6-21-2/h3-4,8H,5-6,9H2,1-2H3 | Cc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)CCOC)C#N | |
| AKOS005253281 | 381.364 | C14 H15 N5 O6 S | RKFLCJQGGFIXMC-UHFFFAOYSA-N | InChI=1S/C14H15N5O6S/c1-18-11(14(22)25-17-18)7-16-10-6-12(20)19(13(10)21)8-2-4-9(5-3-8)26(15,23)24/h2-5,10,16H,6-7H2,1H3,(H2-,15,17,22,23,24) | C[n+]1c(c(on1)[O-])CNC2CC(=O)N(C2=O)c3ccc(cc3)S(=O)(=O)N | |
| AKOS005215560 | 345.38 | C14 H15 N7 O2 S | OXUGDRBSJQOSNT-UHFFFAOYSA-N | InChI=1S/C14H15N7O2S/c1-6(2)21-11(14(23-20-21)19-7(3)22)10-8(4-15)12(17)24-13(18)9(10)5-16/h6,10H,17-18H2,1-3H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)C)C2C(=C(SC(=C2C#N)N)N)C#N | |
| AKOS005252859 | 345.38 | C14 H15 N7 O2 S | MOCZVTSRWJVASC-UHFFFAOYSA-N | InChI=1S/C14H15N7O2S/c1-10(2)20-8-13(23-19-20)15-12(22)9-24-14-16-17-18-21(14)11-6-4-3-5-7-11/h3-8,10H,9H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nnnn2c3ccccc3 | |
| AKOS005253392 | 361.379 | C14 H15 N7 O3 S | CNQKUFRHTOSZFK-UHFFFAOYSA-N | InChI=1S/C14H15N7O3S/c1-23-8-7-20-9-13(24-19-20)15-12(22)10-25-14-16-17-18-21(14)11-5-3-2-4-6-11/h2-6,9H,7-8,10H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2nnnn2c3ccccc3 | |
| AKOS005215016 | 309.748 | C14 H16 Cl N3 O3 | FIKPBHZAMIDWSX-UHFFFAOYSA-N | InChI=1S/C14H16ClN3O3/c1-10(19)16-14-12(9-15)18(17-21-14)8-7-11-5-3-4-6-13(11)20-2/h3-6H,7-9H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)CCc2ccccc2OC)CCl | |
| AKOS005215618 | 309.748 | C14 H16 Cl N3 O3 | RZFOTTMZQHJXSQ-UHFFFAOYSA-N | InChI=1S/C14H16ClN3O3/c1-14(2,3)20-13(19)16-12-9-18(17-21-12)8-10-6-4-5-7-11(10)15/h4-7,9H,8H2,1-3H3 | CC(C)(C)OC(=O)[N-]c1c[n+](no1)Cc2ccccc2Cl | |
| AKOS005251688 | 341.813 | C14 H16 Cl N3 O3 S | YTUKCPBEPYDZDP-UHFFFAOYSA-N | InChI=1S/C14H16ClN3O3S/c1-4-11(22-13-14(20)21-17-18(13)3)12(19)16-9-6-5-8(2)10(15)7-9/h5-7,11H,4H2,1-3H3,(H-,16,17,19,20) | CCC(C(=O)Nc1ccc(c(c1)Cl)C)Sc2c(on[n+]2C)[O-] | |
| AKOS005251703 | 341.813 | C14 H16 Cl N3 O3 S | OGEWSYSXPKFYQK-UHFFFAOYSA-N | InChI=1S/C14H16ClN3O3S/c1-4-11(22-13-14(20)21-17-18(13)3)12(19)16-10-7-5-6-9(15)8(10)2/h5-7,11H,4H2,1-3H3,(H-,16,17,19,20) | CCC(C(=O)Nc1cccc(c1C)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005252116 | 341.813 | C14 H16 Cl N3 O3 S | DEDXTTFEOLTCGJ-UHFFFAOYSA-N | InChI=1S/C14H16ClN3O3S/c1-4-11(22-13-14(20)21-17-18(13)3)12(19)16-10-7-9(15)6-5-8(10)2/h5-7,11H,4H2,1-3H3,(H-,16,17,19,20) | CCC(C(=O)Nc1cc(ccc1C)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005215707 | 325.748 | C14 H16 Cl N3 O4 | TXZHDZAPXJAQLB-UHFFFAOYSA-N | InChI=1S/C14H16ClN3O4/c1-20-11-4-3-10(7-12(11)21-2)5-6-18-9-14(22-17-18)16-13(19)8-15/h3-4,7,9H,5-6,8H2,1-2H3 | COc1ccc(cc1OC)CC[n+]2cc(on2)[N-]C(=O)CCl | |
| AKOS005251444 | 357.813 | C14 H16 Cl N3 O4 S | GKVFLDBJDSJXDQ-UHFFFAOYSA-N | InChI=1S/C14H16ClN3O4S/c1-7-5-10(11(21-4)6-9(7)15)16-12(19)8(2)23-13-14(20)22-17-18(13)3/h5-6,8H,1-4H3,(H-,16,17,19,20) | Cc1cc(c(cc1Cl)OC)NC(=O)C(C)Sc2c(on[n+]2C)[O-] | |
| AKOS005251894 | 357.813 | C14 H16 Cl N3 O4 S | NCGLOURRQXNDBD-UHFFFAOYSA-N | InChI=1S/C14H16ClN3O4S/c1-4-11(23-13-14(20)22-17-18(13)2)12(19)16-9-7-8(15)5-6-10(9)21-3/h5-7,11H,4H2,1-3H3,(H-,16,17,19,20) | CCC(C(=O)Nc1cc(ccc1OC)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005252002 | 357.813 | C14 H16 Cl N3 O4 S | YDGNRHRXGCAOON-UHFFFAOYSA-N | InChI=1S/C14H16ClN3O4S/c1-4-11(23-13-14(20)22-17-18(13)2)12(19)16-8-5-6-10(21-3)9(15)7-8/h5-7,11H,4H2,1-3H3,(H-,16,17,19,20) | CCC(C(=O)Nc1ccc(c(c1)Cl)OC)Sc2c(on[n+]2C)[O-] | |
| AKOS005252359 | 357.813 | C14 H16 Cl N3 O4 S | IDTIZLKJYXZPHU-UHFFFAOYSA-N | InChI=1S/C14H16ClN3O4S/c1-8-6-10(11(21-3)7-9(8)15)16-12(19)4-5-23-13-14(20)22-17-18(13)2/h6-7H,4-5H2,1-3H3,(H-,16,17,19,20) | Cc1cc(c(cc1Cl)OC)NC(=O)CCSc2c(on[n+]2C)[O-] | |
| AKOS005251455 | 373.812 | C14 H16 Cl N3 O5 S | XDNRTNLNXZJZKP-UHFFFAOYSA-N | InChI=1S/C14H16ClN3O5S/c1-7(24-13-14(20)23-17-18(13)2)12(19)16-9-5-8(15)10(21-3)6-11(9)22-4/h5-7H,1-4H3,(H-,16,17,19,20) | CC(C(=O)Nc1cc(c(cc1OC)OC)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005252370 | 373.812 | C14 H16 Cl N3 O5 S | NFHXZUMPKFWGHG-UHFFFAOYSA-N | InChI=1S/C14H16ClN3O5S/c1-18-13(14(20)23-17-18)24-5-4-12(19)16-9-6-8(15)10(21-2)7-11(9)22-3/h6-7H,4-5H2,1-3H3,(H-,16,17,19,20) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cc(c(cc2OC)OC)Cl | |
| AKOS005215606 | 293.294 | C14 H16 F N3 O3 | BBVIOBGQXZNFID-UHFFFAOYSA-N | InChI=1S/C14H16FN3O3/c1-14(2,3)20-13(19)16-12-9-18(17-21-12)8-10-4-6-11(15)7-5-10/h4-7,9H,8H2,1-3H3 | CC(C)(C)OC(=O)[N-]c1c[n+](no1)Cc2ccc(cc2)F | |
| AKOS005214287 | 272.302 | C14 H16 N4 O2 | XWASBKRHESMNEC-UHFFFAOYSA-N | InChI=1S/C14H16N4O2/c1-18-13(14(19)20-17-18)9-15-7-6-10-8-16-12-5-3-2-4-11(10)12/h2-5,8,15-16H,6-7,9H2,1H3 | C[n+]1c(c(on1)[O-])CNCCc2c[nH]c3c2cccc3 | |
| AKOS005219803 | 304.367 | C14 H16 N4 O2 S | KIOSKIUCFYYWCQ-UHFFFAOYSA-N | InChI=1S/C14H16N4O2S/c1-17(14(21)15-10-7-8-10)9-12-13(19)20-16-18(12)11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3,(H-,15,16,19,21) | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=S)NC3CC3 | |
| AKOS005219829 | 304.367 | C14 H16 N4 O2 S | RWDMWGJHIUXREP-UHFFFAOYSA-N | InChI=1S/C14H16N4O2S/c1-17-12(13(19)20-16-17)9-18(11-7-8-11)14(21)15-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H-,15,16,19,21) | C[n+]1c(c(on1)[O-])CN(C2CC2)C(=S)Nc3ccccc3 | |
| AKOS005250564 | 288.302 | C14 H16 N4 O3 | LEIZGUKTYXKTDQ-UHFFFAOYSA-N | InChI=1S/C14H16N4O3/c1-16-7-9-17(10-8-16)13(19)12-14(20)21-15-18(12)11-5-3-2-4-6-11/h2-6H,7-10H2,1H3 | CN1CCN(CC1)C(=O)c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005253042 | 320.367 | C14 H16 N4 O3 S | URJKWKJWSXWWFR-UHFFFAOYSA-N | InChI=1S/C14H16N4O3S/c19-13(11-22-12-4-2-1-3-5-12)15-14-10-18(16-21-14)17-6-8-20-9-7-17/h1-5,10H,6-9,11H2 | c1ccc(cc1)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3 | |
| AKOS005251448 | 336.366 | C14 H16 N4 O4 S | CGVHPXFNGHDXEU-UHFFFAOYSA-N | InChI=1S/C14H16N4O4S/c1-8(23-13-14(21)22-17-18(13)3)12(20)16-11-6-4-10(5-7-11)15-9(2)19/h4-8,17,21H,1-3H3 | CC(C(=O)Nc1ccc(cc1)NC(=O)C)Sc2c(on[n+]2C)[O-] | |
| AKOS005251899 | 336.366 | C14 H16 N4 O4 S | OCAVGFIRHMEKDK-UHFFFAOYSA-N | InChI=1S/C14H16N4O4S/c1-3-10(23-13-14(21)22-17-18(13)2)12(20)16-9-6-4-8(5-7-9)11(15)19/h4-7,10H,3H2,1-2H3,(H3-,15,16,17,19,20,21) | CCC(C(=O)Nc1ccc(cc1)C(=O)N)Sc2c(on[n+]2C)[O-] | |
| AKOS005251902 | 336.366 | C14 H16 N4 O4 S | MJHRLQNRFGRLIP-UHFFFAOYSA-N | InChI=1S/C14H16N4O4S/c1-3-10(23-13-14(21)22-17-18(13)2)12(20)16-9-7-5-4-6-8(9)11(15)19/h4-7,10H,3H2,1-2H3,(H3-,15,16,17,19,20,21) | CCC(C(=O)Nc1ccccc1C(=O)N)Sc2c(on[n+]2C)[O-] | |
| AKOS005252373 | 336.366 | C14 H16 N4 O4 S | ASMCBKAPKVIQAW-UHFFFAOYSA-N | InChI=1S/C14H16N4O4S/c1-9(19)15-10-3-5-11(6-4-10)16-12(20)7-8-23-13-14(21)22-17-18(13)2/h3-6,17,21H,7-8H2,1-2H3 | CC(=O)Nc1ccc(cc1)NC(=O)CCSc2c(on[n+]2C)[O-] | |
| AKOS005250642 | 320.301 | C14 H16 N4 O5 | XRFHJGVENLXJLL-UHFFFAOYSA-N | InChI=1S/C14H16N4O5/c1-21-11-4-2-10(3-5-11)18-12(14(20)23-16-18)13(19)15-17-6-8-22-9-7-17/h2-5H,6-9H2,1H3,(H-,15,16,19,20) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NN3CCOCC3 | |
| AKOS005252042 | 352.366 | C14 H16 N4 O5 S | JPMCBXMUOPPMAY-UHFFFAOYSA-N | InChI=1S/C14H16N4O5S/c1-4-11(24-13-14(20)23-16-17(13)3)12(19)15-10-6-5-9(18(21)22)7-8(10)2/h5-7,11H,4H2,1-3H3,(H-,15,16,19,20) | CCC(C(=O)Nc1ccc(cc1C)[N+](=O)[O-])Sc2c(on[n+]2C)[O-] | |
| AKOS005252089 | 352.366 | C14 H16 N4 O5 S | YDAHJLPPXCLCPA-UHFFFAOYSA-N | InChI=1S/C14H16N4O5S/c1-4-11(24-13-14(20)23-16-17(13)3)12(19)15-10-7-9(18(21)22)6-5-8(10)2/h5-7,11H,4H2,1-3H3,(H-,15,16,19,20) | CCC(C(=O)Nc1cc(ccc1C)[N+](=O)[O-])Sc2c(on[n+]2C)[O-] | |
| AKOS005252721 | 332.381 | C14 H16 N6 O2 S | SOBXYSDAJDLMJG-UHFFFAOYSA-N | InChI=1S/C14H16N6O2S/c1-9-5-10(2)16-14(11(9)6-15)23-8-12(21)17-13-7-20(18-22-13)19(3)4/h5,7H,8H2,1-4H3 | Cc1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)N(C)C)C | |
| AKOS005214292 | 330.21 | C14 H17 Cl2 N3 O2 | JXIARVWLXLXOHG-UHFFFAOYSA-N | InChI=1S/C14H17Cl2N3O2/c1-9(2)19-13(14(20)21-18-19)8-17-6-5-10-3-4-11(15)7-12(10)16/h3-4,7,9,17H,5-6,8H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCCc2ccc(cc2Cl)Cl | |
| AKOS005214328 | 259.304 | C14 H17 N3 O2 | RSAQWHJFGPNHPG-UHFFFAOYSA-N | InChI=1S/C14H17N3O2/c18-14-13(10-15-11-6-4-5-7-11)17(16-19-14)12-8-2-1-3-9-12/h1-3,8-9,11,15H,4-7,10H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CCCC3 | |
| AKOS005215472 | 259.304 | C14 H17 N3 O2 | PTCFZKACYAVGES-UHFFFAOYSA-N | InChI=1S/C14H17N3O2/c1-14(2,3)13(18)15-12-11(17(4)16-19-12)10-8-6-5-7-9-10/h5-9H,1-4H3 | CC(C)(C)C(=O)[N-]c1c([n+](no1)C)c2ccccc2 | |
| AKOS005252866 | 291.369 | C14 H17 N3 O2 S | CGOJEUQKJYKLKB-UHFFFAOYSA-N | InChI=1S/C14H17N3O2S/c1-11(2)17-8-14(19-16-17)15-13(18)10-20-9-12-6-4-3-5-7-12/h3-8,11H,9-10H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSCc2ccccc2 | |
| AKOS005252867 | 291.369 | C14 H17 N3 O2 S | PLZCHMQADBDOOE-UHFFFAOYSA-N | InChI=1S/C14H17N3O2S/c1-10(2)17-8-14(19-16-17)15-13(18)9-20-12-6-4-11(3)5-7-12/h4-8,10H,9H2,1-3H3 | Cc1ccc(cc1)SCC(=O)[N-]c2c[n+](no2)C(C)C | |
| AKOS005214195 | 275.303 | C14 H17 N3 O3 | AYPODAIRXVPPJZ-UHFFFAOYSA-N | InChI=1S/C14H17N3O3/c18-14-13(10-15-9-12-7-4-8-19-12)17(16-20-14)11-5-2-1-3-6-11/h1-3,5-6,12,15H,4,7-10H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCC3CCCO3 | |
| AKOS005215046 | 275.303 | C14 H17 N3 O3 | BXJHONFDHKZEQX-UHFFFAOYSA-N | InChI=1S/C14H17N3O3/c1-9-4-6-12(7-5-9)8-17-13(10(2)18)14(20-16-17)15-11(3)19/h4-7,10,18H,8H2,1-3H3 | Cc1ccc(cc1)C[n+]2c(c(on2)[N-]C(=O)C)C(C)O | |
| AKOS005215061 | 275.303 | C14 H17 N3 O3 | NOWCINIWYQDAIC-UHFFFAOYSA-N | InChI=1S/C14H17N3O3/c1-10(18)13-14(15-11(2)19)20-16-17(13)9-8-12-6-4-3-5-7-12/h3-7,10,18H,8-9H2,1-2H3 | CC(c1c(on[n+]1CCc2ccccc2)[N-]C(=O)C)O | |
| AKOS005215604 | 275.303 | C14 H17 N3 O3 | LPSAIKFZYWUQAL-UHFFFAOYSA-N | InChI=1S/C14H17N3O3/c1-14(2,3)19-13(18)15-12-10-17(16-20-12)9-11-7-5-4-6-8-11/h4-8,10H,9H2,1-3H3 | CC(C)(C)OC(=O)[N-]c1c[n+](no1)Cc2ccccc2 | |
| AKOS005219502 | 275.303 | C14 H17 N3 O3 | RJIIAXWBLQXHNF-UHFFFAOYSA-N | InChI=1S/C14H17N3O3/c1-3-7-13(18)16(2)10-12-14(19)20-15-17(12)11-8-5-4-6-9-11/h4-6,8-9H,3,7,10H2,1-2H3 | CCCC(=O)N(C)Cc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005251220 | 307.368 | C14 H17 N3 O3 S | QKGWPWNHCJZYKN-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-9(2)10-4-6-11(7-5-10)15-12(18)8-21-13-14(19)20-16-17(13)3/h4-7,9H,8H2,1-3H3,(H-,15,16,18,19) | CC(C)c1ccc(cc1)NC(=O)CSc2c(on[n+]2C)[O-] | |
| AKOS005251224 | 307.368 | C14 H17 N3 O3 S | IWIXUJUJAUTZFM-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-4-10-7-5-6-9(2)12(10)15-11(18)8-21-13-14(19)20-16-17(13)3/h5-7H,4,8H2,1-3H3,(H-,15,16,18,19) | CCc1cccc(c1NC(=O)CSc2c(on[n+]2C)[O-])C | |
| AKOS005251410 | 307.368 | C14 H17 N3 O3 S | WFFLZMDCFMBFIG-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-8-6-5-7-11(9(8)2)15-12(18)10(3)21-13-14(19)20-16-17(13)4/h5-7,10H,1-4H3,(H-,15,16,18,19) | Cc1cccc(c1C)NC(=O)C(C)Sc2c(on[n+]2C)[O-] | |
| AKOS005251413 | 307.368 | C14 H17 N3 O3 S | ONVFXTZJNNCKHJ-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-8-5-6-11(9(2)7-8)15-12(18)10(3)21-13-14(19)20-16-17(13)4/h5-7,10H,1-4H3,(H-,15,16,18,19) | Cc1ccc(c(c1)C)NC(=O)C(C)Sc2c(on[n+]2C)[O-] | |
| AKOS005251414 | 307.368 | C14 H17 N3 O3 S | WKUKTDYZWRLSOJ-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-8-5-6-9(2)11(7-8)15-12(18)10(3)21-13-14(19)20-16-17(13)4/h5-7,10H,1-4H3,(H-,15,16,18,19) | Cc1ccc(c(c1)NC(=O)C(C)Sc2c(on[n+]2C)[O-])C | |
| AKOS005251415 | 307.368 | C14 H17 N3 O3 S | ZRPZGTATFHEVIJ-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-8-5-6-11(7-9(8)2)15-12(18)10(3)21-13-14(19)20-16-17(13)4/h5-7,10H,1-4H3,(H-,15,16,18,19) | Cc1ccc(cc1C)NC(=O)C(C)Sc2c(on[n+]2C)[O-] | |
| AKOS005251423 | 307.368 | C14 H17 N3 O3 S | LKZNZNSMYUPIPR-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-8-5-9(2)7-11(6-8)15-12(18)10(3)21-13-14(19)20-16-17(13)4/h5-7,10H,1-4H3,(H-,15,16,18,19) | Cc1cc(cc(c1)NC(=O)C(C)Sc2c(on[n+]2C)[O-])C | |
| AKOS005251475 | 307.368 | C14 H17 N3 O3 S | CVQDJNCLCZFLOR-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-8-6-5-7-9(2)11(8)15-12(18)10(3)21-13-14(19)20-16-17(13)4/h5-7,10H,1-4H3,(H-,15,16,18,19) | Cc1cccc(c1NC(=O)C(C)Sc2c(on[n+]2C)[O-])C | |
| AKOS005252024 | 307.368 | C14 H17 N3 O3 S | IUFBJRQYTSSUHE-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-4-11(21-13-14(19)20-16-17(13)3)12(18)15-10-8-6-5-7-9(10)2/h5-8,11H,4H2,1-3H3,(H-,15,16,18,19) | CCC(C(=O)Nc1ccccc1C)Sc2c(on[n+]2C)[O-] | |
| AKOS005252027 | 307.368 | C14 H17 N3 O3 S | VRWTUCRCAPSXDA-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-4-11(21-13-14(19)20-16-17(13)3)12(18)15-10-7-5-6-9(2)8-10/h5-8,11H,4H2,1-3H3,(H-,15,16,18,19) | CCC(C(=O)Nc1cccc(c1)C)Sc2c(on[n+]2C)[O-] | |
| AKOS005252030 | 307.368 | C14 H17 N3 O3 S | YKBKFTWKFUOJDF-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-4-11(21-13-14(19)20-16-17(13)3)12(18)15-10-7-5-9(2)6-8-10/h5-8,11H,4H2,1-3H3,(H-,15,16,18,19) | CCC(C(=O)Nc1ccc(cc1)C)Sc2c(on[n+]2C)[O-] | |
| AKOS005252299 | 307.368 | C14 H17 N3 O3 S | BFMWUUMQBIKXCW-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-9-5-4-6-10(2)12(9)15-11(18)7-8-21-13-14(19)20-16-17(13)3/h4-6H,7-8H2,1-3H3,(H-,15,16,18,19) | Cc1cccc(c1NC(=O)CCSc2c(on[n+]2C)[O-])C | |
| AKOS005252317 | 307.368 | C14 H17 N3 O3 S | ACIMYLNZJLYIFK-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-9-5-4-6-11(10(9)2)15-12(18)7-8-21-13-14(19)20-16-17(13)3/h4-6H,7-8H2,1-3H3,(H-,15,16,18,19) | Cc1cccc(c1C)NC(=O)CCSc2c(on[n+]2C)[O-] | |
| AKOS005252326 | 307.368 | C14 H17 N3 O3 S | IECLUOYOKCBXCH-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-9-4-5-11(10(2)8-9)15-12(18)6-7-21-13-14(19)20-16-17(13)3/h4-5,8H,6-7H2,1-3H3,(H-,15,16,18,19) | Cc1ccc(c(c1)C)NC(=O)CCSc2c(on[n+]2C)[O-] | |
| AKOS005252327 | 307.368 | C14 H17 N3 O3 S | RLMQSDCJHLOFAS-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-9-4-5-10(2)11(8-9)15-12(18)6-7-21-13-14(19)20-16-17(13)3/h4-5,8H,6-7H2,1-3H3,(H-,15,16,18,19) | Cc1ccc(c(c1)NC(=O)CCSc2c(on[n+]2C)[O-])C | |
| AKOS005252328 | 307.368 | C14 H17 N3 O3 S | QQVKDTRYBOELST-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-9-4-5-11(8-10(9)2)15-12(18)6-7-21-13-14(19)20-16-17(13)3/h4-5,8H,6-7H2,1-3H3,(H-,15,16,18,19) | Cc1ccc(cc1C)NC(=O)CCSc2c(on[n+]2C)[O-] | |
| AKOS005252337 | 307.368 | C14 H17 N3 O3 S | TXZOMSCIZFWGPA-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-9-6-10(2)8-11(7-9)15-12(18)4-5-21-13-14(19)20-16-17(13)3/h6-8H,4-5H2,1-3H3,(H-,15,16,18,19) | Cc1cc(cc(c1)NC(=O)CCSc2c(on[n+]2C)[O-])C | |
| AKOS005253401 | 307.368 | C14 H17 N3 O3 S | TVBXXCDKPAPQIY-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-19-8-7-17-9-14(20-16-17)15-13(18)11-21-10-12-5-3-2-4-6-12/h2-6,9H,7-8,10-11H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSCc2ccccc2 | |
| AKOS005253402 | 307.368 | C14 H17 N3 O3 S | MTJOTFSJSILVOM-UHFFFAOYSA-N | InChI=1S/C14H17N3O3S/c1-11-3-5-12(6-4-11)21-10-13(18)15-14-9-17(16-20-14)7-8-19-2/h3-6,9H,7-8,10H2,1-2H3 | Cc1ccc(cc1)SCC(=O)[N-]c2c[n+](no2)CCOC | |
| AKOS005214230 | 291.302 | C14 H17 N3 O4 | VCAFMENJRRSOPA-UHFFFAOYSA-N | InChI=1S/C14H17N3O4/c1-9(2)17-11(14(18)21-16-17)7-15-6-10-3-4-12-13(5-10)20-8-19-12/h3-5,9,15H,6-8H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCc2ccc3c(c2)OCO3 | |
| AKOS005215059 | 291.302 | C14 H17 N3 O4 | PEVUVWGTMQEPTJ-UHFFFAOYSA-N | InChI=1S/C14H17N3O4/c1-9(18)13-14(15-10(2)19)21-16-17(13)8-11-4-6-12(20-3)7-5-11/h4-7,9,18H,8H2,1-3H3 | CC(c1c(on[n+]1Cc2ccc(cc2)OC)[N-]C(=O)C)O | |
| AKOS005215566 | 291.302 | C14 H17 N3 O4 | KMOUADCWLYFJQG-UHFFFAOYSA-N | InChI=1S/C14H17N3O4/c1-10(18)15-14-9-17(16-21-14)7-6-11-4-5-12(19-2)13(8-11)20-3/h4-5,8-9H,6-7H2,1-3H3 | CC(=O)[N-]c1c[n+](no1)CCc2ccc(c(c2)OC)OC | |
| AKOS005215625 | 291.302 | C14 H17 N3 O4 | LXUURJDZVCTZQB-UHFFFAOYSA-N | InChI=1S/C14H17N3O4/c1-10(19)15-14-12(9-18)17(16-21-14)8-7-11-5-3-4-6-13(11)20-2/h3-6,18H,7-9H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)CCc2ccccc2OC)CO | |
| AKOS005250157 | 291.302 | C14 H17 N3 O4 | HRZLGGFVPCXFOM-UHFFFAOYSA-N | InChI=1S/C14H17N3O4/c1-4-9(2)15-13(18)12-14(19)21-16-17(12)10-5-7-11(20-3)8-6-10/h5-9H,4H2,1-3H3,(H-,15,16,18,19) | CCC(C)NC(=O)c1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005250158 | 291.302 | C14 H17 N3 O4 | CWJBCCOBIFUJEN-UHFFFAOYSA-N | InChI=1S/C14H17N3O4/c1-14(2,3)15-12(18)11-13(19)21-16-17(11)9-5-7-10(20-4)8-6-9/h5-8H,1-4H3,(H-,15,16,18,19) | CC(C)(C)NC(=O)c1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005250537 | 291.302 | C14 H17 N3 O4 | OIPAGUUSMLNBLN-UHFFFAOYSA-N | InChI=1S/C14H17N3O4/c1-3-4-9-20-11-7-5-10(6-8-11)15-13(18)12-14(19)21-16-17(12)2/h5-8H,3-4,9H2,1-2H3,(H-,15,16,18,19) | CCCCOc1ccc(cc1)NC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005250584 | 291.302 | C14 H17 N3 O4 | YRIJRRNWNZKHTL-UHFFFAOYSA-N | InChI=1S/C14H17N3O4/c1-4-16(5-2)13(18)12-14(19)21-15-17(12)10-6-8-11(20-3)9-7-10/h6-9H,4-5H2,1-3H3 | CCN(CC)C(=O)c1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005251417 | 323.367 | C14 H17 N3 O4 S | BWJDYZSNFJJSJK-UHFFFAOYSA-N | InChI=1S/C14H17N3O4S/c1-4-20-11-8-6-5-7-10(11)15-12(18)9(2)22-13-14(19)21-16-17(13)3/h5-9H,4H2,1-3H3,(H-,15,16,18,19) | CCOc1ccccc1NC(=O)C(C)Sc2c(on[n+]2C)[O-] | |
| AKOS005251418 | 323.367 | C14 H17 N3 O4 S | KQOFQPWFAKLPCR-UHFFFAOYSA-N | InChI=1S/C14H17N3O4S/c1-4-20-11-7-5-10(6-8-11)15-12(18)9(2)22-13-14(19)21-16-17(13)3/h5-9H,4H2,1-3H3,(H-,15,16,18,19) | CCOc1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2C)[O-] | |
| AKOS005252048 | 323.367 | C14 H17 N3 O4 S | FBJTXKZOOZPOSH-UHFFFAOYSA-N | InChI=1S/C14H17N3O4S/c1-4-11(22-13-14(19)21-16-17(13)2)12(18)15-9-5-7-10(20-3)8-6-9/h5-8,11H,4H2,1-3H3,(H-,15,16,18,19) | CCC(C(=O)Nc1ccc(cc1)OC)Sc2c(on[n+]2C)[O-] | |
| AKOS005252094 | 323.367 | C14 H17 N3 O4 S | PZIMKVXLEXZKEF-UHFFFAOYSA-N | InChI=1S/C14H17N3O4S/c1-4-11(22-13-14(19)21-16-17(13)2)12(18)15-9-7-5-6-8-10(9)20-3/h5-8,11H,4H2,1-3H3,(H-,15,16,18,19) | CCC(C(=O)Nc1ccccc1OC)Sc2c(on[n+]2C)[O-] | |
| AKOS005252109 | 323.367 | C14 H17 N3 O4 S | XNYCPOGNTUVGCJ-UHFFFAOYSA-N | InChI=1S/C14H17N3O4S/c1-4-11(22-13-14(19)21-16-17(13)2)12(18)15-9-6-5-7-10(8-9)20-3/h5-8,11H,4H2,1-3H3,(H-,15,16,18,19) | CCC(C(=O)Nc1cccc(c1)OC)Sc2c(on[n+]2C)[O-] | |
| AKOS005252341 | 323.367 | C14 H17 N3 O4 S | DBBCDRZMWBADFS-UHFFFAOYSA-N | InChI=1S/C14H17N3O4S/c1-3-20-11-7-5-4-6-10(11)15-12(18)8-9-22-13-14(19)21-16-17(13)2/h4-7H,3,8-9H2,1-2H3,(H-,15,16,18,19) | CCOc1ccccc1NC(=O)CCSc2c(on[n+]2C)[O-] | |
| AKOS005252342 | 323.367 | C14 H17 N3 O4 S | DRXUNNWEFZTEFR-UHFFFAOYSA-N | InChI=1S/C14H17N3O4S/c1-3-20-11-6-4-10(5-7-11)15-12(18)8-9-22-13-14(19)21-16-17(13)2/h4-7H,3,8-9H2,1-2H3,(H-,15,16,18,19) | CCOc1ccc(cc1)NC(=O)CCSc2c(on[n+]2C)[O-] | |
| AKOS005250356 | 307.302 | C14 H17 N3 O5 | XSKOFLNNMDPHCT-UHFFFAOYSA-N | InChI=1S/C14H17N3O5/c1-16(8-9-14(19)22-15-17(9)2)13(18)12-10(20-3)6-5-7-11(12)21-4/h5-7H,8H2,1-4H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)c2c(cccc2OC)OC | |
| AKOS005250384 | 307.302 | C14 H17 N3 O5 | XCPDHNLMQRXZIK-UHFFFAOYSA-N | InChI=1S/C14H17N3O5/c1-16(8-10-14(19)22-15-17(10)2)13(18)9-5-6-11(20-3)12(7-9)21-4/h5-7H,8H2,1-4H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)c2ccc(c(c2)OC)OC | |
| AKOS005250656 | 307.302 | C14 H17 N3 O5 | PUWSFKHFZHFUOS-UHFFFAOYSA-N | InChI=1S/C14H17N3O5/c1-20-9-3-8-15-13(18)12-14(19)22-16-17(12)10-4-6-11(21-2)7-5-10/h4-7H,3,8-9H2,1-2H3,(H-,15,16,18,19) | COCCCNC(=O)c1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005251465 | 339.367 | C14 H17 N3 O5 S | KOTIMMUBSUDPJB-UHFFFAOYSA-N | InChI=1S/C14H17N3O5S/c1-8(23-13-14(19)22-16-17(13)2)12(18)15-10-6-5-9(20-3)7-11(10)21-4/h5-8H,1-4H3,(H-,15,16,18,19) | CC(C(=O)Nc1ccc(cc1OC)OC)Sc2c(on[n+]2C)[O-] | |
| AKOS005251473 | 339.367 | C14 H17 N3 O5 S | GCYAOSGYJUARIP-UHFFFAOYSA-N | InChI=1S/C14H17N3O5S/c1-8(23-13-14(19)22-16-17(13)2)12(18)15-10-7-9(20-3)5-6-11(10)21-4/h5-8H,1-4H3,(H-,15,16,18,19) | CC(C(=O)Nc1cc(ccc1OC)OC)Sc2c(on[n+]2C)[O-] | |
| AKOS005251474 | 339.367 | C14 H17 N3 O5 S | ZWPAMKDLHADPLG-UHFFFAOYSA-N | InChI=1S/C14H17N3O5S/c1-8(23-13-14(19)22-16-17(13)2)12(18)15-9-5-10(20-3)7-11(6-9)21-4/h5-8H,1-4H3,(H-,15,16,18,19) | CC(C(=O)Nc1cc(cc(c1)OC)OC)Sc2c(on[n+]2C)[O-] | |
| AKOS005252297 | 339.367 | C14 H17 N3 O5 S | GUYHPOWVYMWHRO-UHFFFAOYSA-N | InChI=1S/C14H17N3O5S/c1-17-13(14(19)22-16-17)23-7-6-12(18)15-10-8-9(20-2)4-5-11(10)21-3/h4-5,8H,6-7H2,1-3H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cc(ccc2OC)OC | |
| AKOS005252298 | 339.367 | C14 H17 N3 O5 S | MMBYJILQFJIBIU-UHFFFAOYSA-N | InChI=1S/C14H17N3O5S/c1-17-13(14(19)22-16-17)23-5-4-12(18)15-9-6-10(20-2)8-11(7-9)21-3/h6-8H,4-5H2,1-3H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cc(cc(c2)OC)OC | |
| AKOS005252380 | 339.367 | C14 H17 N3 O5 S | VFCQRLCATZVNMJ-UHFFFAOYSA-N | InChI=1S/C14H17N3O5S/c1-17-13(14(19)22-16-17)23-7-6-12(18)15-10-5-4-9(20-2)8-11(10)21-3/h4-5,8H,6-7H2,1-3H3,(H-,15,16,18,19) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2OC)OC | |
| AKOS005250641 | 323.301 | C14 H17 N3 O6 | XBLTVACJVKGJAB-UHFFFAOYSA-N | InChI=1S/C14H17N3O6/c1-20-10-6-4-9(5-7-10)17-12(14(19)23-16-17)13(18)15-8-11(21-2)22-3/h4-7,11H,8H2,1-3H3,(H-,15,16,18,19) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCC(OC)OC | |
| AKOS005253084 | 319.382 | C14 H17 N5 O2 S | CDSGVHAIJLEGSO-UHFFFAOYSA-N | InChI=1S/C14H17N5O2S/c20-12(11-22-14-6-2-3-7-15-14)16-13-10-19(17-21-13)18-8-4-1-5-9-18/h2-3,6-7,10H,1,4-5,8-9,11H2 | c1ccnc(c1)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3 | |
| AKOS005253009 | 335.381 | C14 H17 N5 O3 S | HQXHBOXCKMKPFC-UHFFFAOYSA-N | InChI=1S/C14H17N5O3S/c15-11-2-1-3-12(8-11)23-10-13(20)16-14-9-19(17-22-14)18-4-6-21-7-5-18/h1-3,8-9H,4-7,10,15H2 | c1cc(cc(c1)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3)N | |
| AKOS005219505 | 319.316 | C14 H17 N5 O4 | MUDNAJVNCXRHQB-UHFFFAOYSA-N | InChI=1S/C14H17N5O4/c1-9(2)19-11(6-10(7-15)8-16)12(22-18-19)17-23-13(20)21-14(3,4)5/h6,9H,1-5H3 | CC(C)[n+]1c(c(on1)[N-]OC(=O)OC(C)(C)C)C=C(C#N)C#N | |
| AKOS005214192 | 295.765 | C14 H18 Cl N3 O2 | ITONNJDBSSRVJF-UHFFFAOYSA-N | InChI=1S/C14H18ClN3O2/c1-10(2)18-13(14(19)20-17-18)9-16-7-6-11-4-3-5-12(15)8-11/h3-5,8,10,16H,6-7,9H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCCc2cccc(c2)Cl | |
| AKOS005214290 | 295.765 | C14 H18 Cl N3 O2 | RZHQGCFNHCEPPU-UHFFFAOYSA-N | InChI=1S/C14H18ClN3O2/c1-10(2)18-13(14(19)20-17-18)9-16-8-7-11-5-3-4-6-12(11)15/h3-6,10,16H,7-9H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCCc2ccccc2Cl | |
| AKOS005214291 | 295.765 | C14 H18 Cl N3 O2 | HAUGRNKKYPZVFW-UHFFFAOYSA-N | InChI=1S/C14H18ClN3O2/c1-10(2)18-13(14(19)20-17-18)9-16-8-7-11-3-5-12(15)6-4-11/h3-6,10,16H,7-9H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCCc2ccc(cc2)Cl | |
| AKOS005214280 | 279.31 | C14 H18 F N3 O2 | XUMPVVQBYSHKIM-UHFFFAOYSA-N | InChI=1S/C14H18FN3O2/c1-10(2)18-13(14(19)20-17-18)9-16-8-7-11-3-5-12(15)6-4-11/h3-6,10,16H,7-9H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCCc2ccc(cc2)F | |
| AKOS005214281 | 279.31 | C14 H18 F N3 O2 | DJPOUPAAOIFAEK-UHFFFAOYSA-N | InChI=1S/C14H18FN3O2/c1-10(2)18-13(14(19)20-17-18)9-16-8-7-11-5-3-4-6-12(11)15/h3-6,10,16H,7-9H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCCc2ccccc2F | |
| AKOS005214801 | 274.318 | C14 H18 N4 O2 | CTRCBXIRPPJSEF-UHFFFAOYSA-N | InChI=1S/C14H18N4O2/c19-14-13(11-15-17-9-5-2-6-10-17)18(16-20-14)12-7-3-1-4-8-12/h1,3-4,7-8,15H,2,5-6,9-11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNN3CCCCC3 | |
| AKOS005214960 | 274.318 | C14 H18 N4 O2 | LIHVXRHOFZHMGZ-UHFFFAOYSA-N | InChI=1S/C14H18N4O2/c1-10-4-6-12(7-5-10)9-18-13(8-15-3)14(20-17-18)16-11(2)19/h4-7,15H,8-9H2,1-3H3 | Cc1ccc(cc1)C[n+]2c(c(on2)[N-]C(=O)C)CNC | |
| AKOS005214974 | 274.318 | C14 H18 N4 O2 | TVTVBRDOWLEYJW-UHFFFAOYSA-N | InChI=1S/C14H18N4O2/c1-11(19)16-14-13(10-15-2)18(17-20-14)9-8-12-6-4-3-5-7-12/h3-7,15H,8-10H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)CCc2ccccc2)CNC | |
| AKOS005215581 | 274.318 | C14 H18 N4 O2 | CDDJHVIPFFZWEO-UHFFFAOYSA-N | InChI=1S/C14H18N4O2/c1-10(2)18-12(9-15-3)14(20-17-18)16-13(19)11-7-5-4-6-8-11/h4-8,10,15H,9H2,1-3H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CNC | |
| AKOS005250094 | 306.383 | C14 H18 N4 O2 S | MIOWXEHCNYCWRD-UHFFFAOYSA-N | InChI=1S/C14H18N4O2S/c1-3-15-14(21)18(9-11-7-5-4-6-8-11)10-12-13(19)20-16-17(12)2/h4-8H,3,9-10H2,1-2H3,(H-,15,16,19,21) | CCNC(=S)N(Cc1ccccc1)Cc2c(on[n+]2C)[O-] | |
| AKOS005214785 | 290.318 | C14 H18 N4 O3 | ADNAHZYPTQTRLU-UHFFFAOYSA-N | InChI=1S/C14H18N4O3/c1-11-2-4-12(5-3-11)18-13(14(19)21-16-18)10-15-17-6-8-20-9-7-17/h2-5,15H,6-10H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNN3CCOCC3 | |
| AKOS005214878 | 290.318 | C14 H18 N4 O3 | VVCZOBKARSYCQK-UHFFFAOYSA-N | InChI=1S/C14H18N4O3/c1-10(19)16-14-12(9-15)18(17-21-14)8-7-11-5-3-4-6-13(11)20-2/h3-6H,7-9,15H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)CCc2ccccc2OC)CN | |
| AKOS005214972 | 290.318 | C14 H18 N4 O3 | ACDJNKFPBYZYJM-UHFFFAOYSA-N | InChI=1S/C14H18N4O3/c1-10(19)16-14-13(8-15-2)18(17-21-14)9-11-4-6-12(20-3)7-5-11/h4-7,15H,8-9H2,1-3H3 | CC(=O)[N-]c1c([n+](no1)Cc2ccc(cc2)OC)CNC | |
| AKOS005219788 | 322.383 | C14 H18 N4 O3 S | SPIWETUOXGIIQW-UHFFFAOYSA-N | InChI=1S/C14H18N4O3S/c1-4-15-14(22)17(2)9-12-13(19)21-16-18(12)10-5-7-11(20-3)8-6-10/h5-8H,4,9H2,1-3H3,(H-,15,16,19,22) | CCNC(=S)N(C)Cc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005253157 | 322.383 | C14 H18 N4 O3 S | NLNXACAVFDOARH-UHFFFAOYSA-N | InChI=1S/C14H18N4O3S/c19-13(11-22-10-12-5-4-8-20-12)15-14-9-18(16-21-14)17-6-2-1-3-7-17/h4-5,8-9H,1-3,6-7,10-11H2 | c1cc(oc1)CSCC(=O)[N-]c2c[n+](no2)N3CCCCC3 | |
| AKOS005214803 | 306.317 | C14 H18 N4 O4 | LZWVEWDUHWERCR-UHFFFAOYSA-N | InChI=1S/C14H18N4O4/c1-20-12-4-2-11(3-5-12)18-13(14(19)22-16-18)10-15-17-6-8-21-9-7-17/h2-5,15H,6-10H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNN3CCOCC3 | |
| AKOS005250644 | 306.317 | C14 H18 N4 O4 | NXEMZBXTNDODBM-UHFFFAOYSA-N | InChI=1S/C14H18N4O4/c1-17(2)9-8-15-13(19)12-14(20)22-16-18(12)10-4-6-11(21-3)7-5-10/h4-7H,8-9H2,1-3H3,(H-,15,16,19,20) | CN(C)CCNC(=O)c1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005250087 | 338.382 | C14 H18 N4 O4 S | AELBGYHXLRXKSJ-UHFFFAOYSA-N | InChI=1S/C14H18N4O4S/c1-15-14(23)17(7-8-19)9-12-13(20)22-16-18(12)10-3-5-11(21-2)6-4-10/h3-6,19H,7-9H2,1-2H3,(H-,15,16,20,23) | CNC(=S)N(CCO)Cc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005252935 | 350.396 | C14 H18 N6 O3 S | MCLWOHNMDNDCJF-UHFFFAOYSA-N | InChI=1S/C14H18N6O3S/c1-10-7-11(2)16-14(15-10)24-9-12(21)17-13-8-20(18-23-13)19-3-5-22-6-4-19/h7-8H,3-6,9H2,1-2H3 | Cc1cc(nc(n1)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3)C | |
| AKOS005214221 | 261.32 | C14 H19 N3 O2 | OPAKLUJWFKZZQZ-UHFFFAOYSA-N | InChI=1S/C14H19N3O2/c1-10(2)17-13(14(18)19-16-17)9-15-11(3)12-7-5-4-6-8-12/h4-8,10-11,15H,9H2,1-3H3 | CC(C)[n+]1c(c(on1)[O-])CNC(C)c2ccccc2 | |
| AKOS005214222 | 261.32 | C14 H19 N3 O2 | JLSZLBIRNLXQBP-UHFFFAOYSA-N | InChI=1S/C14H19N3O2/c1-10(2)17-13(14(18)19-16-17)9-15-8-12-6-4-11(3)5-7-12/h4-7,10,15H,8-9H2,1-3H3 | Cc1ccc(cc1)CNCc2c(on[n+]2C(C)C)[O-] | |
| AKOS005214223 | 261.32 | C14 H19 N3 O2 | SDQODOHYZWXHTG-UHFFFAOYSA-N | InChI=1S/C14H19N3O2/c1-11(2)17-13(14(18)19-16-17)10-15-9-8-12-6-4-3-5-7-12/h3-7,11,15H,8-10H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCCc2ccccc2 | |
| AKOS005214224 | 261.32 | C14 H19 N3 O2 | AIKINOVVEFIYDB-UHFFFAOYSA-N | InChI=1S/C14H19N3O2/c1-4-14(2,3)15-10-12-13(18)19-16-17(12)11-8-6-5-7-9-11/h5-9,15H,4,10H2,1-3H3 | CCC(C)(C)NCc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005214725 | 261.32 | C14 H19 N3 O2 | FDSVZKRQCWOTRP-UHFFFAOYSA-N | InChI=1S/C14H19N3O2/c1-4-11(3)15-9-13-14(18)19-16-17(13)12-7-5-10(2)6-8-12/h5-8,11,15H,4,9H2,1-3H3 | CCC(C)NCc1c(on[n+]1c2ccc(cc2)C)[O-] | |
| AKOS005214734 | 261.32 | C14 H19 N3 O2 | AWYNMAZGDSUKSK-UHFFFAOYSA-N | InChI=1S/C14H19N3O2/c1-10-5-7-11(8-6-10)17-12(13(18)19-16-17)9-15-14(2,3)4/h5-8,15H,9H2,1-4H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNC(C)(C)C | |
| AKOS005214158 | 277.319 | C14 H19 N3 O3 | CKRDZAVBGOIHTH-UHFFFAOYSA-N | InChI=1S/C14H19N3O3/c1-2-19-10-6-9-15-11-13-14(18)20-16-17(13)12-7-4-3-5-8-12/h3-5,7-8,15H,2,6,9-11H2,1H3 | CCOCCCNCc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005214731 | 277.319 | C14 H19 N3 O3 | LTAKMRIVKZEOTN-UHFFFAOYSA-N | InChI=1S/C14H19N3O3/c1-4-10(2)15-9-13-14(18)20-16-17(13)11-5-7-12(19-3)8-6-11/h5-8,10,15H,4,9H2,1-3H3 | CCC(C)NCc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005214732 | 277.319 | C14 H19 N3 O3 | MRFDMZJLYAFBBI-UHFFFAOYSA-N | InChI=1S/C14H19N3O3/c1-14(2,3)15-9-12-13(18)20-16-17(12)10-5-7-11(19-4)8-6-10/h5-8,15H,9H2,1-4H3 | CC(C)(C)NCc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005214806 | 277.319 | C14 H19 N3 O3 | BDGUEEKVXQFCPX-UHFFFAOYSA-N | InChI=1S/C14H19N3O3/c1-11-4-6-12(7-5-11)17-13(14(18)20-16-17)10-15-8-3-9-19-2/h4-7,15H,3,8-10H2,1-2H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCCOC | |
| AKOS005214253 | 293.318 | C14 H19 N3 O4 | YPENILVHKIZKLR-UHFFFAOYSA-N | InChI=1S/C14H19N3O4/c1-17-11(14(18)21-16-17)9-15-7-6-10-4-5-12(19-2)13(8-10)20-3/h4-5,8,15H,6-7,9H2,1-3H3 | C[n+]1c(c(on1)[O-])CNCCc2ccc(c(c2)OC)OC | |
| AKOS005214746 | 293.318 | C14 H19 N3 O4 | UFSQONYUSHTXMI-UHFFFAOYSA-N | InChI=1S/C14H19N3O4/c1-10-4-6-11(7-5-10)17-12(14(18)21-16-17)8-15-9-13(19-2)20-3/h4-7,13,15H,8-9H2,1-3H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCC(OC)OC | |
| AKOS005214815 | 293.318 | C14 H19 N3 O4 | LSRJVVMOTAWOCS-UHFFFAOYSA-N | InChI=1S/C14H19N3O4/c1-19-9-3-8-15-10-13-14(18)21-16-17(13)11-4-6-12(20-2)7-5-11/h4-7,15H,3,8-10H2,1-2H3 | COCCCNCc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005214754 | 309.318 | C14 H19 N3 O5 | RVSKENOKVYJGOU-UHFFFAOYSA-N | InChI=1S/C14H19N3O5/c1-19-11-6-4-10(5-7-11)17-12(14(18)22-16-17)8-15-9-13(20-2)21-3/h4-7,13,15H,8-9H2,1-3H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCC(OC)OC | |
| AKOS005251357 | 373.448 | C14 H19 N3 O5 S2 | CXZXAKOJNOUHQB-UHFFFAOYSA-N | InChI=1S/C14H19N3O5S2/c1-3-21-12(19)9-4-6-17(7-5-9)14(23)24-8-10(18)11-13(20)22-15-16(11)2/h9H,3-8H2,1-2H3 | CCOC(=O)C1CCN(CC1)C(=S)SCC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005253008 | 337.397 | C14 H19 N5 O3 S | SRRWSWSSSAYAIY-UHFFFAOYSA-N | InChI=1S/C14H19N5O3S/c15-11-1-3-12(4-2-11)23-10-13(20)16-14-9-19(17-22-14)18-5-7-21-8-6-18/h1,3,9H,2,4-8,10,15H2 | c1c(on[n+]1N2CCOCC2)[N-]C(=O)CSC3=CC=C(CC3)N | |
| AKOS005214795 | 276.334 | C14 H20 N4 O2 | SINXVGMUCKSUTG-UHFFFAOYSA-N | InChI=1S/C14H20N4O2/c1-11-4-6-12(7-5-11)18-13(14(19)20-16-18)10-15-8-9-17(2)3/h4-7,15H,8-10H2,1-3H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCN(C)C | |
| AKOS005214810 | 276.334 | C14 H20 N4 O2 | GJXGOFGDVXLWSN-UHFFFAOYSA-N | InChI=1S/C14H20N4O2/c1-17(2)10-6-9-15-11-13-14(19)20-16-18(13)12-7-4-3-5-8-12/h3-5,7-8,15H,6,9-11H2,1-2H3 | CN(C)CCCNCc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005214805 | 292.334 | C14 H20 N4 O3 | OUROLLXQZRDIHU-UHFFFAOYSA-N | InChI=1S/C14H20N4O3/c1-17(2)9-8-15-10-13-14(19)21-16-18(13)11-4-6-12(20-3)7-5-11/h4-7,15H,8-10H2,1-3H3 | CN(C)CCNCc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005214268 | 340.398 | C14 H20 N4 O4 S | TWNVLLYORSYOFW-UHFFFAOYSA-N | InChI=1S/C14H20N4O4S/c1-10(2)18-13(14(19)22-17-18)9-16-8-7-11-3-5-12(6-4-11)23(15,20)21/h3-6,10,16H,7-9H2,1-2H3,(H2-,15,17,19,20,21) | CC(C)[n+]1c(c(on1)[O-])CNCCc2ccc(cc2)S(=O)(=O)N | |
| AKOS005253023 | 326.414 | C14 H22 N4 O3 S | MGQZDLGYOBIXDZ-UHFFFAOYSA-N | InChI=1S/C14H22N4O3S/c19-13(11-22-12-4-2-1-3-5-12)15-14-10-18(16-21-14)17-6-8-20-9-7-17/h10,12H,1-9,11H2 | c1c(on[n+]1N2CCOCC2)[N-]C(=O)CSC3CCCCC3 | |
| AKOS005214179 | 265.351 | C14 H23 N3 O2 | VCXCGPQZWBFRNT-UHFFFAOYSA-N | InChI=1S/C14H23N3O2/c1-11(2)17-13(14(18)19-16-17)10-15-9-8-12-6-4-3-5-7-12/h6,11,15H,3-5,7-10H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCCC2=CCCCC2 | |
| AKOS005215591 | 281.351 | C14 H23 N3 O3 | OIXQRHQSAXNQIO-UHFFFAOYSA-N | InChI=1S/C14H23N3O3/c1-14(2,3)19-13(18)15-12-10-17(16-20-12)11-8-6-4-5-7-9-11/h10-11H,4-9H2,1-3H3 | CC(C)(C)OC(=O)[N-]c1c[n+](no1)C2CCCCCC2 | |
| AKOS005215714 | 328.194 | C14 H5 F5 N2 O2 | MGVNNKUJDAVMCC-UHFFFAOYSA-N | InChI=1S/C14H5F5N2O2/c15-8-7(9(16)11(18)12(19)10(8)17)13-14(22)23-20-21(13)6-4-2-1-3-5-6/h1-5H | c1ccc(cc1)[n+]2c(c(on2)[O-])c3c(c(c(c(c3F)F)F)F)F | |
| AKOS005215636 | 317.137 | C14 H9 Br N2 O2 | ZYTJDWCUQROASD-UHFFFAOYSA-N | InChI=1S/C14H9BrN2O2/c15-11-8-6-10(7-9-11)13-14(18)19-16-17(13)12-4-2-1-3-5-12/h1-9H | c1ccc(cc1)[n+]2c(c(on2)[O-])c3ccc(cc3)Br | MFCD09881656 |
| AKOS005215623 | 283.239 | C14 H9 N3 O4 | NEWOFQLSXIQUAE-UHFFFAOYSA-N | InChI=1S/C14H9N3O4/c18-14-13(10-5-4-8-12(9-10)17(19)20)16(15-21-14)11-6-2-1-3-7-11/h1-9H | c1ccc(cc1)[n+]2c(c(on2)[O-])c3cccc(c3)N(=O)=O | |
| AKOS005219773 | 338.344 | C15 H10 N6 O2 S | QFWXZHLJUZCEEQ-UHFFFAOYSA-N | InChI=1S/C15H10N6O2S/c16-6-9-11(10(7-17)14(19)24-13(9)18)12-15(22)23-20-21(12)8-4-2-1-3-5-8/h1-5,11H,18-19H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C3C(=C(SC(=C3C#N)N)N)C#N | |
| AKOS005250844 | 313.331 | C15 H11 N3 O3 S | YAULHVZQYYETLE-UHFFFAOYSA-N | InChI=1S/C15H11N3O3S/c19-12(10-22-13-8-4-5-9-16-13)14-15(20)21-17-18(14)11-6-2-1-3-7-11/h1-9H,10H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3ccccn3 | |
| AKOS003578260 | 297.266 | C15 H11 N3 O4 | JLQWDCNIPFRPHN-UHFFFAOYSA-N | InChI=1S/C15H11N3O4/c19-15-14(10-11-6-8-13(9-7-11)18(20)21)17(16-22-15)12-4-2-1-3-5-12/h1-9H,10H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])Cc3ccc(cc3)[N+](=O)[O-] | MFCD03211602 |
| AKOS005215612 | 252.268 | C15 H12 N2 O2 | GXWRPWSXROQFOQ-UHFFFAOYSA-N | InChI=1S/C15H12N2O2/c18-15-14(13-9-5-2-6-10-13)17(16-19-15)11-12-7-3-1-4-8-12/h1-10H,11H2 | c1ccc(cc1)C[n+]2c(c(on2)[O-])c3ccccc3 | MFCD09881668 |
| AKOS005215624 | 284.333 | C15 H12 N2 O2 S | DHSMHLXVFXCXFA-UHFFFAOYSA-N | InChI=1S/C15H12N2O2S/c18-15-14(20-11-12-7-3-1-4-8-12)17(16-19-15)13-9-5-2-6-10-13/h1-10H,11H2 | c1ccc(cc1)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005219521 | 316.332 | C15 H12 N2 O4 S | CGKZMAOCMOSMLI-UHFFFAOYSA-N | InChI=1S/C15H12N2O4S/c18-13(10-22-9-12-7-4-8-20-12)14-15(19)21-16-17(14)11-5-2-1-3-6-11/h1-8H,9-10H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSCc3ccco3 | |
| AKOS005219832 | 280.281 | C15 H12 N4 O2 | UAYUKJFKOABGAE-UHFFFAOYSA-O | InChI=1S/C15H11N4O2/c20-15-14(11-16-17-12-7-3-1-4-8-12)19(18-21-15)13-9-5-2-6-10-13/h1-11H/q-1/p+1 | c1ccc(cc1)N/N=C/c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250405 | 344.345 | C15 H12 N4 O4 S | KYZSSWWFXIYQBL-UHFFFAOYSA-N | InChI=1S/C15H12N4O4S/c1-22-11-5-3-10(4-6-11)19-13(14(21)23-18-19)12(20)9-24-15-16-7-2-8-17-15/h2-8H,9H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3ncccn3 | |
| AKOS005250409 | 376.344 | C15 H12 N4 O6 S | QYABDFUAZGIXLB-UHFFFAOYSA-N | InChI=1S/C15H12N4O6S/c1-24-9-4-2-8(3-5-9)19-13(14(23)25-18-19)10(20)7-26-15-16-11(21)6-12(22)17-15/h2-6H,7H2,1H3,(H2-,16,17,18,20,21,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nc(cc(n3)O)O | |
| AKOS005250706 | 356.359 | C15 H12 N6 O3 S | FLTLVSHIRCPWCJ-UHFFFAOYSA-N | InChI=1S/C15H12N6O3S/c1-21-12(15(23)24-20-21)10(22)6-25-14-9(5-17)11(7-2-3-7)8(4-16)13(18)19-14/h7H,2-3,6H2,1H3,(H2-,18,19,20,22,23) | C[n+]1c(c(on1)[O-])C(=O)CSc2c(c(c(c(n2)N)C#N)C3CC3)C#N | |
| AKOS005252825 | 380.872 | C15 H13 Cl N4 O2 S2 | CUWLIDSUBNJZBY-UHFFFAOYSA-N | InChI=1S/C15H13ClN4O2S2/c1-2-20-7-14(22-19-20)18-13(21)9-24-15-17-12(8-23-15)10-3-5-11(16)6-4-10/h3-8H,2,9H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2nc(cs2)c3ccc(cc3)Cl | |
| AKOS005253353 | 386.283 | C15 H13 F3 N4 O5 | LEGFOTXZSOXTRZ-UHFFFAOYSA-N | InChI=1S/C15H13F3N4O5/c1-21-11(14(25)27-20-21)7-19-10-6-12(23)22(13(10)24)8-2-4-9(5-3-8)26-15(16,17)18/h2-5,10,19H,6-7H2,1H3 | C[n+]1c(c(on1)[O-])CNC2CC(=O)N(C2=O)c3ccc(cc3)OC(F)(F)F | |
| AKOS005215702 | 284.25 | C15 H13 N2 O2 P | MLAXINBVZMRJRQ-UHFFFAOYSA-N | InChI=1S/C15H13N2O2P/c1-17-14(15(18)19-16-17)20(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3 | C[n+]1c(c(on1)[O-])P(c2ccccc2)c3ccccc3 | |
| AKOS005250255 | 315.347 | C15 H13 N3 O3 S | AMHQKVFZAZFQJT-UHFFFAOYSA-N | InChI=1S/C15H13N3O3S/c1-17(14(19)13-8-5-9-22-13)10-12-15(20)21-16-18(12)11-6-3-2-4-7-11/h2-9H,10H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)c3cccs3 | |
| AKOS005250265 | 315.347 | C15 H13 N3 O3 S | IGIBSKSTYZPTSV-UHFFFAOYSA-N | InChI=1S/C15H13N3O3S/c1-17(14(19)11-7-8-22-10-11)9-13-15(20)21-16-18(13)12-5-3-2-4-6-12/h2-8,10H,9H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)c3ccsc3 | |
| AKOS005251233 | 315.347 | C15 H13 N3 O3 S | JUIZPYJPHZGJQI-UHFFFAOYSA-N | InChI=1S/C15H13N3O3S/c1-18-14(15(20)21-17-18)22-9-13(19)16-12-7-6-10-4-2-3-5-11(10)8-12/h2-8H,9H2,1H3,(H-,16,17,19,20) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc3ccccc3c2 | |
| AKOS005251234 | 315.347 | C15 H13 N3 O3 S | FECKUMSCFNXGDV-UHFFFAOYSA-N | InChI=1S/C15H13N3O3S/c1-18-14(15(20)21-17-18)22-9-13(19)16-12-8-4-6-10-5-2-3-7-11(10)12/h2-8H,9H2,1H3,(H-,16,17,19,20) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2cccc3c2cccc3 | |
| AKOS005250987 | 347.412 | C15 H13 N3 O3 S2 | UOUFYCIJSWQYDO-UHFFFAOYSA-N | InChI=1S/C15H13N3O3S2/c1-9-3-5-10(6-4-9)11-7-22-15(16-11)23-8-12(19)13-14(20)21-17-18(13)2/h3-7H,8H2,1-2H3 | Cc1ccc(cc1)c2csc(n2)SCC(=O)c3c(on[n+]3C)[O-] | |
| AKOS005215711 | 299.281 | C15 H13 N3 O4 | HDAWGOUUINDOSL-UHFFFAOYSA-N | InChI=1S/C15H13N3O4/c1-21-11-7-5-10(6-8-11)18-13(15(20)22-17-18)14(19)12-4-2-3-9-16-12/h2-9,14,19H,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(c3ccccn3)O | |
| AKOS005250382 | 299.281 | C15 H13 N3 O4 | YFOWPLDLFGCXBS-UHFFFAOYSA-N | InChI=1S/C15H13N3O4/c1-17(14(19)13-8-5-9-21-13)10-12-15(20)22-16-18(12)11-6-3-2-4-7-11/h2-9H,10H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)c3ccco3 | |
| AKOS005250174 | 331.346 | C15 H13 N3 O4 S | IQMHKLAMDMJYGR-UHFFFAOYSA-N | InChI=1S/C15H13N3O4S/c1-21-11-6-4-10(5-7-11)18-13(15(20)22-17-18)14(19)16-9-12-3-2-8-23-12/h2-8H,9H2,1H3,(H-,16,17,19,20) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCc3cccs3 | |
| AKOS005251081 | 363.411 | C15 H13 N3 O4 S2 | VNLLJSDEXRQOEO-UHFFFAOYSA-N | InChI=1S/C15H13N3O4S2/c1-18-13(14(20)22-17-18)12(19)8-24-15-16-11(7-23-15)9-3-5-10(21-2)6-4-9/h3-7H,8H2,1-2H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2nc(cs2)c3ccc(cc3)OC | |
| AKOS005250112 | 315.281 | C15 H13 N3 O5 | HIWYNYTZMLNCLH-UHFFFAOYSA-N | InChI=1S/C15H13N3O5/c1-3-22-14(19)10(9-16)8-13-15(20)23-17-18(13)11-4-6-12(21-2)7-5-11/h4-8H,3H2,1-2H3 | CCOC(=O)/C(=C/c1c(on[n+]1c2ccc(cc2)OC)[O-])/C#N | |
| AKOS005250150 | 315.281 | C15 H13 N3 O5 | WTZOTVHCOGKRMB-UHFFFAOYSA-N | InChI=1S/C15H13N3O5/c1-21-11-6-4-10(5-7-11)18-13(15(20)23-17-18)14(19)16-9-12-3-2-8-22-12/h2-8H,9H2,1H3,(H-,16,17,19,20) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCc3ccco3 | |
| AKOS005252417 | 355.374 | C15 H13 N7 O2 S | IYTBIOPQYSPRLW-UHFFFAOYSA-N | InChI=1S/C15H13N7O2S/c1-22-6-12(24-21-22)19-11(23)7-25-15-10(5-17)13(8-2-3-8)9(4-16)14(18)20-15/h6,8H,2-3,7H2,1H3,(H2-,18,19,20,21,23) | C[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)C3CC3)C#N | |
| AKOS005252463 | 355.374 | C15 H13 N7 O2 S | YXYOGIRSAREKHU-UHFFFAOYSA-N | InChI=1S/C15H13N7O2S/c1-2-22-7-12(24-21-22)17-11(23)8-25-15-18-14-13(19-20-15)9-5-3-4-6-10(9)16-14/h3-7H,2,8H2,1H3,(H-,16,17,18,19,20,21,23) | CC[n+]1cc(on1)[N-]C(=O)CSc2nc3c(c4ccccc4[nH]3)nn2 | |
| AKOS005253154 | 395.887 | C15 H14 Cl N5 O2 S2 | YHIMVQSUARDXOJ-UHFFFAOYSA-N | InChI=1S/C15H14ClN5O2S2/c1-20(2)21-7-14(23-19-21)18-13(22)9-25-15-17-12(8-24-15)10-3-5-11(16)6-4-10/h3-8H,9H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2nc(cs2)c3ccc(cc3)Cl | |
| AKOS005250307 | 357.285 | C15 H14 F3 N3 O4 | FOPYXVQPUZYYKI-UHFFFAOYSA-N | InChI=1S/C15H14F3N3O4/c1-24-11-6-4-10(5-7-11)21-12(13(22)25-19-21)8-20(9-2-3-9)14(23)15(16,17)18/h4-7,9H,2-3,8H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)C(F)(F)F | |
| AKOS005252901 | 385.364 | C15 H14 F3 N5 O2 S | OGEHVBZDYRDCRN-UHFFFAOYSA-N | InChI=1S/C15H14F3N5O2S/c1-8(2)23-6-13(25-22-23)21-12(24)7-26-14-10(5-19)11(15(16,17)18)4-9(3)20-14/h4,6,8H,7H2,1-3H3 | Cc1cc(c(c(n1)SCC(=O)[N-]c2c[n+](no2)C(C)C)C#N)C(F)(F)F | |
| AKOS005252902 | 385.364 | C15 H14 F3 N5 O2 S | UJIXTFDUJSDDFD-UHFFFAOYSA-N | InChI=1S/C15H14F3N5O2S/c1-8(2)23-6-13(25-22-23)21-12(24)7-26-14-10(5-19)9(3)4-11(20-14)15(16,17)18/h4,6,8H,7H2,1-3H3 | Cc1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)C(C)C)C(F)(F)F | |
| AKOS005253300 | 401.364 | C15 H14 F3 N5 O3 S | VHVOTSGZTOHKIQ-UHFFFAOYSA-N | InChI=1S/C15H14F3N5O3S/c1-9-5-11(15(16,17)18)10(6-19)14(20-9)27-8-12(24)21-13-7-23(22-26-13)3-4-25-2/h5,7H,3-4,8H2,1-2H3 | Cc1cc(c(c(n1)SCC(=O)[N-]c2c[n+](no2)CCOC)C#N)C(F)(F)F | |
| AKOS005253301 | 401.364 | C15 H14 F3 N5 O3 S | ZJMMROFZTAHMFF-UHFFFAOYSA-N | InChI=1S/C15H14F3N5O3S/c1-9-5-11(15(16,17)18)20-14(10(9)6-19)27-8-12(24)21-13-7-23(22-26-13)3-4-25-2/h5,7H,3-4,8H2,1-2H3 | Cc1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)CCOC)C(F)(F)F | |
| AKOS005214225 | 282.297 | C15 H14 N4 O2 | POOBGMDMLSWQQH-UHFFFAOYSA-N | InChI=1S/C15H14N4O2/c20-15-14(11-17-10-12-5-4-8-16-9-12)19(18-21-15)13-6-2-1-3-7-13/h1-9,17H,10-11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3cccnc3 | |
| AKOS005252478 | 346.427 | C15 H14 N4 O2 S2 | CJALCWPXDBJXFQ-UHFFFAOYSA-N | InChI=1S/C15H14N4O2S2/c1-10-3-5-11(6-4-10)12-8-22-15(16-12)23-9-13(20)17-14-7-19(2)18-21-14/h3-8H,9H2,1-2H3 | Cc1ccc(cc1)c2csc(n2)SCC(=O)[N-]c3c[n+](no3)C | |
| AKOS005252823 | 346.427 | C15 H14 N4 O2 S2 | SXYIIKCTEVXJLW-UHFFFAOYSA-N | InChI=1S/C15H14N4O2S2/c1-2-19-8-14(21-18-19)17-13(20)10-23-15-16-12(9-22-15)11-6-4-3-5-7-11/h3-9H,2,10H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2nc(cs2)c3ccccc3 | |
| AKOS005250726 | 330.362 | C15 H14 N4 O3 S | LBYSQYZIQFUEHQ-UHFFFAOYSA-N | InChI=1S/C15H14N4O3S/c1-19-13(15(21)22-18-19)12(20)8-23-14-10(7-16)6-9-4-2-3-5-11(9)17-14/h6H,2-5,8H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2c(cc3c(n2)CCCC3)C#N | |
| AKOS005251497 | 330.362 | C15 H14 N4 O3 S | CZZQZMRMPZUPSR-UHFFFAOYSA-N | InChI=1S/C15H14N4O3S/c1-9(23-14-15(21)22-18-19(14)2)13(20)17-12-7-3-6-11-10(12)5-4-8-16-11/h3-9H,1-2H3,(H-,16,17,18,20,21) | CC(C(=O)Nc1cccc2c1cccn2)Sc3c(on[n+]3C)[O-] | |
| AKOS005252334 | 330.362 | C15 H14 N4 O3 S | YFWYRBIBMWWXJG-UHFFFAOYSA-N | InChI=1S/C15H14N4O3S/c1-19-14(15(21)22-18-19)23-9-7-13(20)17-12-6-2-5-11-10(12)4-3-8-16-11/h2-6,8H,7,9H2,1H3,(H-,16,17,18,20,21) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cccc3c2cccn3 | |
| AKOS005253848 | 330.362 | C15 H14 N4 O3 S | ONRMGFZPBOZPJX-UHFFFAOYSA-N | InChI=1S/C15H14N4O3S/c1-7(2)6-8-4-5-9-10(16)13(23-14(9)17-8)12(20)11-15(21)22-18-19(11)3/h4-6H,1-3H3,(H2-,16,18,20,21) | CC(=Cc1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3C)[O-])N)C | |
| AKOS005253882 | 330.362 | C15 H14 N4 O3 S | LQQKHCLXDHQKCU-UHFFFAOYSA-N | InChI=1S/C15H14N4O3S/c1-19-11(15(21)22-18-19)12(20)13-10(16)8-6-7-4-2-3-5-9(7)17-14(8)23-13/h6H,2-5H2,1H3,(H2-,16,18,20,21) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3cc4c(nc3s2)CCCC4)N | |
| AKOS005252486 | 362.427 | C15 H14 N4 O3 S2 | AVBLVPZLFNIVAP-UHFFFAOYSA-N | InChI=1S/C15H14N4O3S2/c1-19-7-14(22-18-19)17-13(20)9-24-15-16-12(8-23-15)10-3-5-11(21-2)6-4-10/h3-8H,9H2,1-2H3 | C[n+]1cc(on1)[N-]C(=O)CSc2nc(cs2)c3ccc(cc3)OC | |
| AKOS005250404 | 346.361 | C15 H14 N4 O4 S | JRRUMZWNZHZDJW-UHFFFAOYSA-N | InChI=1S/C15H14N4O4S/c1-18-8-7-16-15(18)24-9-12(20)13-14(21)23-17-19(13)10-3-5-11(22-2)6-4-10/h3-8H,9H2,1-2H3 | Cn1ccnc1SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250701 | 346.361 | C15 H14 N4 O4 S | ZZDPIYFVSOGOPS-UHFFFAOYSA-N | InChI=1S/C15H14N4O4S/c1-3-19-13(21)9-6-4-5-7-10(9)16-15(19)24-8-11(20)12-14(22)23-17-18(12)2/h4-7H,3,8H2,1-2H3 | CCn1c(=O)c2ccccc2nc1SCC(=O)c3c(on[n+]3C)[O-] | |
| AKOS005250725 | 362.36 | C15 H14 N4 O5 S | PJJCYLMWDBWKSD-UHFFFAOYSA-N | InChI=1S/C15H14N4O5S/c1-4-23-14(21)9-5-8(2)17-13(10(9)6-16)25-7-11(20)12-15(22)24-18-19(12)3/h5H,4,7H2,1-3H3 | CCOC(=O)c1cc(nc(c1C#N)SCC(=O)c2c(on[n+]2C)[O-])C | |
| AKOS005253671 | 362.36 | C15 H14 N4 O5 S | HQSWMOUJXJPQMA-UHFFFAOYSA-N | InChI=1S/C15H14N4O5S/c1-4-23-14(21)7-5-6(2)17-13-8(7)9(16)12(25-13)11(20)10-15(22)24-18-19(10)3/h5H,4H2,1-3H3,(H2-,16,18,20,22) | CCOC(=O)c1cc(nc2c1c(c(s2)C(=O)c3c(on[n+]3C)[O-])N)C | |
| AKOS005250757 | 358.375 | C15 H14 N6 O3 S | UXHLFWYUUMKRBH-UHFFFAOYSA-N | InChI=1S/C15H14N6O3S/c1-7(2)11-8(4-16)13(18)19-14(9(11)5-17)25-6-10(22)12-15(23)24-20-21(12)3/h7H,6H2,1-3H3,(H2-,18,19,20,22,23) | CC(C)c1c(c(nc(c1C#N)SCC(=O)c2c(on[n+]2C)[O-])N)C#N | |
| AKOS005253888 | 358.375 | C15 H14 N6 O3 S | IAQHEGHWDWJJPP-UHFFFAOYSA-N | InChI=1S/C15H14N6O3S/c1-5(2)7-6(4-16)13(18)19-14-8(7)9(17)12(25-14)11(22)10-15(23)24-20-21(10)3/h5H,1-3H3,(H4-,17,18,19,20,22,23) | CC(C)c1c(c(nc2c1c(c(s2)C(=O)c3c(on[n+]3C)[O-])N)N)C#N | |
| AKOS005250408 | 374.374 | C15 H14 N6 O4 S | RWJVGWJZJZXLPT-UHFFFAOYSA-N | InChI=1S/C15H14N6O4S/c1-24-9-4-2-8(3-5-9)21-13(14(23)25-20-21)10(22)7-26-15-18-11(16)6-12(17)19-15/h2-6H,7H2,1H3,(H4-,16,17,18,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nc(cc(n3)N)N | |
| AKOS005252689 | 370.389 | C15 H14 N8 O2 S | UIZMBXLADBLKQD-UHFFFAOYSA-N | InChI=1S/C15H14N8O2S/c1-22(2)23-7-12(25-21-23)17-11(24)8-26-15-18-14-13(19-20-15)9-5-3-4-6-10(9)16-14/h3-7H,8H2,1-2H3,(H-,16,17,18,19,20,21,24) | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2nc3c(c4ccccc4[nH]3)nn2 | |
| AKOS005215615 | 422.197 | C15 H15 Br F3 N3 O3 | OEBNMNPEFSATFN-UHFFFAOYSA-N | InChI=1S/C15H15BrF3N3O3/c1-8(2)22-12(14(25-21-22)20-11(23)7-16)13(24)9-3-5-10(6-4-9)15(17,18)19/h3-6,8,13,24H,7H2,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)CBr)C(c2ccc(cc2)C(F)(F)F)O | |
| AKOS005251271 | 395.208 | C15 H15 Br N4 O4 | DLHJWRWUPIENBS-UHFFFAOYSA-N | InChI=1S/C15H15BrN4O4/c1-18(8-12-15(23)24-17-19(12)2)11-7-13(21)20(14(11)22)10-5-3-9(16)4-6-10/h3-6,11H,7-8H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C2CC(=O)N(C2=O)c3ccc(cc3)Br | |
| AKOS005251264 | 350.757 | C15 H15 Cl N4 O4 | GOEYUZLBCKCSHN-UHFFFAOYSA-N | InChI=1S/C15H15ClN4O4/c1-18(8-12-15(23)24-17-19(12)2)11-7-13(21)20(14(11)22)10-5-3-9(16)4-6-10/h3-6,11H,7-8H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C2CC(=O)N(C2=O)c3ccc(cc3)Cl | |
| AKOS005251270 | 334.302 | C15 H15 F N4 O4 | RWTBTRCRJIJVCV-UHFFFAOYSA-N | InChI=1S/C15H15FN4O4/c1-18(8-12-15(23)24-17-19(12)2)11-7-13(21)20(14(11)22)10-5-3-9(16)4-6-10/h3-6,11H,7-8H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C2CC(=O)N(C2=O)c3ccc(cc3)F | |
| AKOS005214715 | 301.364 | C15 H15 N3 O2 S | CMKHVYSJEPMSNU-UHFFFAOYSA-N | InChI=1S/C15H15N3O2S/c1-11-4-6-12(7-5-11)18-14(15(19)20-17-18)10-16-9-13-3-2-8-21-13/h2-8,16H,9-10H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3cccs3 | |
| AKOS005214857 | 285.298 | C15 H15 N3 O3 | LWSDXMWKLWPSSD-UHFFFAOYSA-N | InChI=1S/C15H15N3O3/c1-11-4-6-12(7-5-11)18-14(15(19)21-17-18)10-16-9-13-3-2-8-20-13/h2-8,16H,9-10H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3ccco3 | |
| AKOS005214720 | 317.363 | C15 H15 N3 O3 S | BHNSGPLWLZIJFI-UHFFFAOYSA-N | InChI=1S/C15H15N3O3S/c1-20-12-6-4-11(5-7-12)18-14(15(19)21-17-18)10-16-9-13-3-2-8-22-13/h2-8,16H,9-10H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3cccs3 | |
| AKOS005214854 | 301.297 | C15 H15 N3 O4 | BAUJJVSUMRZOEX-UHFFFAOYSA-N | InChI=1S/C15H15N3O4/c1-20-12-6-4-11(5-7-12)18-14(15(19)22-17-18)10-16-9-13-3-2-8-21-13/h2-8,16H,9-10H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3ccco3 | |
| AKOS005251343 | 365.427 | C15 H15 N3 O4 S2 | QSQVRTOEBVGNBA-UHFFFAOYSA-N | InChI=1S/C15H15N3O4S2/c19-12(10-24-15(23)17-6-8-21-9-7-17)13-14(20)22-16-18(13)11-4-2-1-3-5-11/h1-5H,6-10H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC(=S)N3CCOCC3 | |
| AKOS005252489 | 329.377 | C15 H15 N5 O2 S | OJJRVQLYDRAOFY-UHFFFAOYSA-N | InChI=1S/C15H15N5O2S/c1-2-20-8-14(22-19-20)18-13(21)9-23-15-11(7-16)6-10-4-3-5-12(10)17-15/h6,8H,2-5,9H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCC3)C#N | |
| AKOS005252517 | 329.377 | C15 H15 N5 O2 S | DZHHCRUIPUABKY-UHFFFAOYSA-N | InChI=1S/C15H15N5O2S/c1-20-8-14(22-19-20)18-13(21)9-23-15-11(7-16)6-10-4-2-3-5-12(10)17-15/h6,8H,2-5,9H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCCC3)C#N | |
| AKOS005253145 | 361.442 | C15 H15 N5 O2 S2 | QSFGOOWPFUSWEH-UHFFFAOYSA-N | InChI=1S/C15H15N5O2S2/c1-19(2)20-8-14(22-18-20)17-13(21)10-24-15-16-12(9-23-15)11-6-4-3-5-7-11/h3-9H,10H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2nc(cs2)c3ccccc3 | |
| AKOS005252454 | 345.376 | C15 H15 N5 O3 S | YNJKUWRMAPXPMS-UHFFFAOYSA-N | InChI=1S/C15H15N5O3S/c1-3-20-8-13(23-18-20)17-12(21)9-24-15-16-11-7-5-4-6-10(11)14(22)19(15)2/h4-8H,3,9H2,1-2H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3c(=O)n2C | |
| AKOS005252596 | 345.376 | C15 H15 N5 O3 S | UUPWSJQPJIAAAH-UHFFFAOYSA-N | InChI=1S/C15H15N5O3S/c1-3-20-14(22)10-6-4-5-7-11(10)16-15(20)24-9-12(21)17-13-8-19(2)18-23-13/h4-8H,3,9H2,1-2H3 | CCn1c(=O)c2ccccc2nc1SCC(=O)[N-]c3c[n+](no3)C | |
| AKOS005252515 | 361.376 | C15 H15 N5 O4 S | OOWCXPPBXFUGLJ-UHFFFAOYSA-N | InChI=1S/C15H15N5O4S/c1-4-23-15(22)10-5-9(2)17-14(11(10)6-16)25-8-12(21)18-13-7-20(3)19-24-13/h5,7H,4,8H2,1-3H3 | CCOC(=O)c1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)C)C | |
| AKOS005253031 | 361.376 | C15 H15 N5 O4 S | LQDBABNRHKUMBH-UHFFFAOYSA-N | InChI=1S/C15H15N5O4S/c21-13(10-25-15-16-11-3-1-2-4-12(11)23-15)17-14-9-20(18-24-14)19-5-7-22-8-6-19/h1-4,9H,5-8,10H2 | c1ccc2c(c1)nc(o2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4 | |
| AKOS005251562 | 393.441 | C15 H15 N5 O4 S2 | SWWOGQNENZFTNP-UHFFFAOYSA-N | InChI=1S/C15H15N5O4S2/c1-8(21)20-4-3-9-10(5-16)13(26-11(9)6-20)17-12(22)7-25-14-15(23)24-18-19(14)2/h3-4,6-7H2,1-2H3,(H-,17,18,22,23) | CC(=O)N1CCc2c(sc(c2C#N)NC(=O)CSc3c(on[n+]3C)[O-])C1 | |
| AKOS005253379 | 345.31 | C15 H15 N5 O5 | DDTKFIOZLUMVMQ-UHFFFAOYSA-N | InChI=1S/C15H15N5O5/c1-19-11(15(24)25-18-19)7-17-10-6-12(21)20(14(10)23)9-4-2-8(3-5-9)13(16)22/h2-5,10,17H,6-7H2,1H3,(H2-,16,18,22,24) | C[n+]1c(c(on1)[O-])CNC2CC(=O)N(C2=O)c3ccc(cc3)C(=O)N | |
| AKOS005251306 | 361.31 | C15 H15 N5 O6 | AATNDTKKNVQKIG-UHFFFAOYSA-N | InChI=1S/C15H15N5O6/c1-17(8-12-15(23)26-16-18(12)2)11-7-13(21)19(14(11)22)9-3-5-10(6-4-9)20(24)25/h3-6,11H,7-8H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C2CC(=O)N(C2=O)c3ccc(cc3)[N+](=O)[O-] | |
| AKOS005252411 | 357.39 | C15 H15 N7 O2 S | PNMOGEJFCJWHNI-UHFFFAOYSA-N | InChI=1S/C15H15N7O2S/c1-8(2)13-9(4-16)14(18)20-15(10(13)5-17)25-7-11(23)19-12-6-22(3)21-24-12/h6,8H,7H2,1-3H3,(H2-,18,19,20,21,23) | CC(C)c1c(c(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)C)N)C#N | |
| AKOS005215457 | 343.301 | C15 H16 F3 N3 O3 | VCDXOQRAEHEDJO-UHFFFAOYSA-N | InChI=1S/C15H16F3N3O3/c1-8(2)21-12(14(24-20-21)19-9(3)22)13(23)10-4-6-11(7-5-10)15(16,17)18/h4-8,13,23H,1-3H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)C)C(c2ccc(cc2)C(F)(F)F)O | MFCD09881648 |
| AKOS005251332 | 352.362 | C15 H16 N2 O6 S | UGCIMSCJAYVNJA-UHFFFAOYSA-N | InChI=1S/C15H16N2O6S/c1-3-22-13(19)8-11(18)9-24-14-15(20)23-16-17(14)10-4-6-12(21-2)7-5-10/h4-7H,3,8-9H2,1-2H3 | CCOC(=O)CC(=O)CSc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005219530 | 332.378 | C15 H16 N4 O3 S | NMQDDXWXHOULMU-UHFFFAOYSA-N | InChI=1S/C15H16N4O3S/c1-9(2)6-11-5-4-10(7-16)14(17-11)23-8-12(20)13-15(21)22-18-19(13)3/h4-5,9H,6,8H2,1-3H3 | CC(C)Cc1ccc(c(n1)SCC(=O)c2c(on[n+]2C)[O-])C#N | |
| AKOS005250720 | 332.378 | C15 H16 N4 O3 S | FOKANIKGKCBCES-UHFFFAOYSA-N | InChI=1S/C15H16N4O3S/c1-3-4-5-11-7-6-10(8-16)14(17-11)23-9-12(20)13-15(21)22-18-19(13)2/h6-7H,3-5,9H2,1-2H3 | CCCCc1ccc(c(n1)SCC(=O)c2c(on[n+]2C)[O-])C#N | |
| AKOS005251979 | 332.378 | C15 H16 N4 O3 S | LDLSQEXLXWWNFM-UHFFFAOYSA-N | InChI=1S/C15H16N4O3S/c1-3-12(23-14-15(21)22-18-19(14)2)13(20)17-10-4-5-11-9(8-10)6-7-16-11/h4-8,12,18,21H,3H2,1-2H3 | CCC(C(=O)Nc1ccc2c(c1)cc[nH]2)Sc3c(on[n+]3C)[O-] | |
| AKOS005253870 | 332.378 | C15 H16 N4 O3 S | RSDACAHRAGMFJN-UHFFFAOYSA-N | InChI=1S/C15H16N4O3S/c1-7(2)6-8-4-5-9-10(16)13(23-14(9)17-8)12(20)11-15(21)22-18-19(11)3/h4-5,7H,6H2,1-3H3,(H2-,16,18,20,21) | CC(C)Cc1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3C)[O-])N | |
| AKOS005253873 | 332.378 | C15 H16 N4 O3 S | LITWQJLWBXIXAE-UHFFFAOYSA-N | InChI=1S/C15H16N4O3S/c1-3-4-5-8-6-7-9-10(16)13(23-14(9)17-8)12(20)11-15(21)22-18-19(11)2/h6-7H,3-5H2,1-2H3,(H2-,16,18,20,21) | CCCCc1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3C)[O-])N | |
| AKOS005253893 | 332.378 | C15 H16 N4 O3 S | ZFHDBPQCBSROPC-UHFFFAOYSA-N | InChI=1S/C15H16N4O3S/c1-5-8-6(2)9-10(16)13(23-14(9)17-7(8)3)12(20)11-15(21)22-18-19(11)4/h5H2,1-4H3,(H2-,16,18,20,21) | CCc1c(c2c(c(sc2nc1C)C(=O)c3c(on[n+]3C)[O-])N)C | |
| AKOS005251560 | 364.443 | C15 H16 N4 O3 S2 | YBGKRUJRULHBAV-UHFFFAOYSA-N | InChI=1S/C15H16N4O3S2/c1-8-3-4-9-10(6-16)13(24-11(9)5-8)17-12(20)7-23-14-15(21)22-18-19(14)2/h8H,3-5,7H2,1-2H3,(H-,17,18,20,21) | CC1CCc2c(sc(c2C#N)NC(=O)CSc3c(on[n+]3C)[O-])C1 | |
| AKOS005251832 | 364.443 | C15 H16 N4 O3 S2 | BDYQFQBKXBZPTI-UHFFFAOYSA-N | InChI=1S/C15H16N4O3S2/c1-8(23-14-15(21)22-18-19(14)2)12(20)17-13-10(7-16)9-5-3-4-6-11(9)24-13/h8H,3-6H2,1-2H3,(H-,17,18,20,21) | CC(C(=O)Nc1c(c2c(s1)CCCC2)C#N)Sc3c(on[n+]3C)[O-] | |
| AKOS005252657 | 364.443 | C15 H16 N4 O3 S2 | QRGNKOCDQACHEM-UHFFFAOYSA-N | InChI=1S/C15H16N4O3S2/c1-19-14(15(21)22-18-19)23-7-6-12(20)17-13-10(8-16)9-4-2-3-5-11(9)24-13/h2-7H2,1H3,(H-,17,18,20,21) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2c(c3c(s2)CCCC3)C#N | |
| AKOS005219750 | 316.312 | C15 H16 N4 O4 | MKGGETITYPZYKQ-UHFFFAOYSA-N | InChI=1S/C15H16N4O4/c1-15(2)4-8(20)11-9(5-15)22-13(17)7(6-16)10(11)12-14(21)23-18-19(12)3/h10H,4-5,17H2,1-3H3 | CC1(CC2=C(C(C(=C(O2)N)C#N)c3c(on[n+]3C)[O-])C(=O)C1)C | |
| AKOS005250387 | 316.312 | C15 H16 N4 O4 | QLTKYOFXUXHZGN-UHFFFAOYSA-N | InChI=1S/C15H16N4O4/c1-11(20)17-7-9-18(10-8-17)14(21)13-15(22)23-16-19(13)12-5-3-2-4-6-12/h2-6H,7-10H2,1H3 | CC(=O)N1CCN(CC1)C(=O)c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250500 | 316.312 | C15 H16 N4 O4 | HMJRDLLYIANJPR-UHFFFAOYSA-N | InChI=1S/C15H16N4O4/c16-13(20)10-6-8-18(9-7-10)14(21)12-15(22)23-17-19(12)11-4-2-1-3-5-11/h1-5,10H,6-9H2,(H2-,16,17,20,21,22) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCC(CC3)C(=O)N | |
| AKOS005250501 | 316.312 | C15 H16 N4 O4 | ORWZEZFMEGPDHK-UHFFFAOYSA-N | InChI=1S/C15H16N4O4/c16-13(20)10-5-4-8-18(9-10)14(21)12-15(22)23-17-19(12)11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2,(H2-,16,17,20,21,22) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCCC(C3)C(=O)N | |
| AKOS005251262 | 316.312 | C15 H16 N4 O4 | LAWYRXURQGACHC-UHFFFAOYSA-N | InChI=1S/C15H16N4O4/c1-17(9-12-15(22)23-16-18(12)2)11-8-13(20)19(14(11)21)10-6-4-3-5-7-10/h3-7,11H,8-9H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C2CC(=O)N(C2=O)c3ccccc3 | |
| AKOS005253323 | 316.312 | C15 H16 N4 O4 | VUHNFQZUWKKGTK-UHFFFAOYSA-N | InChI=1S/C15H16N4O4/c1-9-3-5-10(6-4-9)19-13(20)7-11(14(19)21)16-8-12-15(22)23-17-18(12)2/h3-6,11,16H,7-8H2,1-2H3 | Cc1ccc(cc1)N2C(=O)CC(C2=O)NCc3c(on[n+]3C)[O-] | |
| AKOS005251382 | 332.311 | C15 H16 N4 O5 | NCWKTYNRPDKCSI-UHFFFAOYSA-O | InChI=1S/C15H15N4O5/c1-19-12(15(23)24-18-19)9-11(14(22)16-7-8-20)17-13(21)10-5-3-2-4-6-10/h2-6,9,20H,7-8H2,1H3,(H,16,22)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCO)\NC(=O)c2ccccc2 | |
| AKOS005253324 | 332.311 | C15 H16 N4 O5 | PIXJUDOPJRTLSN-UHFFFAOYSA-N | InChI=1S/C15H16N4O5/c1-18-12(15(22)24-17-18)8-16-11-7-13(20)19(14(11)21)9-3-5-10(23-2)6-4-9/h3-6,11,16H,7-8H2,1-2H3 | C[n+]1c(c(on1)[O-])CNC2CC(=O)N(C2=O)c3ccc(cc3)OC | |
| AKOS005250615 | 380.376 | C15 H16 N4 O6 S | QYVWUWTZAKWOGZ-UHFFFAOYSA-N | InChI=1S/C15H16N4O6S/c1-7(20)19-5-4-8-9(6-19)26-13(10(8)14(22)24-3)16-12(21)11-15(23)25-17-18(11)2/h4-6H2,1-3H3,(H-,16,17,21,22,23) | CC(=O)N1CCc2c(sc(c2C(=O)OC)NC(=O)c3c(on[n+]3C)[O-])C1 | |
| AKOS005253340 | 397.903 | C15 H16 N5 O2 S2 . Cl | YFKYNZVZELTJKL-UHFFFAOYSA-N | InChI=1S/C15H15N5O2S2.ClH/c1-20-7-13(22-19-20)18-12(21)8-23-15-10-5-3-2-4-9(10)11(6-16)14(17)24-15;/h7,17H,2-5,8H2,1H3;1H | C[n+]1cc(on1)[N-]C(=O)CSc2c3c(c(c([s+]2)N)C#N)CCCC3.[Cl-] | |
| AKOS005252694 | 344.392 | C15 H16 N6 O2 S | XIVJTFWTJXPDGC-UHFFFAOYSA-N | InChI=1S/C15H16N6O2S/c1-20(2)21-8-14(23-19-21)18-13(22)9-24-15-11(7-16)6-10-4-3-5-12(10)17-15/h6,8H,3-5,9H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCC3)C#N | |
| AKOS005252686 | 360.391 | C15 H16 N6 O3 S | MGQAZFIJQTVQPB-UHFFFAOYSA-N | InChI=1S/C15H16N6O3S/c1-19(2)21-8-13(24-18-21)17-12(22)9-25-15-16-11-7-5-4-6-10(11)14(23)20(15)3/h4-8H,9H2,1-3H3 | Cn1c(=O)c2ccccc2nc1SCC(=O)[N-]c3c[n+](no3)N(C)C | |
| AKOS005252942 | 360.391 | C15 H16 N6 O3 S | FKGMBDYGEPMFIB-UHFFFAOYSA-N | InChI=1S/C15H16N6O3S/c1-11-2-3-12(8-16)15(17-11)25-10-13(22)18-14-9-21(19-24-14)20-4-6-23-7-5-20/h2-3,9H,4-7,10H2,1H3 | Cc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3)C#N | |
| AKOS005253038 | 360.391 | C15 H16 N6 O3 S | PGTWMLTYYMWOKN-UHFFFAOYSA-N | InChI=1S/C15H16N6O3S/c22-13(10-25-15-16-11-3-1-2-4-12(11)17-15)18-14-9-21(19-24-14)20-5-7-23-8-6-20/h1-4,9H,5-8,10H2,(H-,16,17,18,19,22) | c1ccc2c(c1)[nH]c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4 | |
| AKOS005253041 | 388.404 | C15 H16 N8 O3 S | QJKMRZXANDOBAI-UHFFFAOYSA-N | InChI=1S/C15H16N8O3S/c24-13(16-14-10-22(20-26-14)21-6-8-25-9-7-21)11-27-15-17-18-19-23(15)12-4-2-1-3-5-12/h1-5,10H,6-9,11H2 | c1ccc(cc1)n2c(nnn2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4 | |
| AKOS005253148 | 352.839 | C15 H17 Cl N4 O2 S | QWPUQZGWWPFVNC-UHFFFAOYSA-N | InChI=1S/C15H17ClN4O2S/c16-12-4-6-13(7-5-12)23-11-14(21)17-15-10-20(18-22-15)19-8-2-1-3-9-19/h4-7,10H,1-3,8-9,11H2 | c1cc(ccc1SCC(=O)[N-]c2c[n+](no2)N3CCCCC3)Cl | |
| AKOS005250264 | 287.314 | C15 H17 N3 O3 | NHMXBMXVPMQVMK-UHFFFAOYSA-N | InChI=1S/C15H17N3O3/c1-17(14(19)11-6-5-7-11)10-13-15(20)21-16-18(13)12-8-3-2-4-9-12/h2-4,8-9,11H,5-7,10H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)C3CCC3 | |
| AKOS005250391 | 287.314 | C15 H17 N3 O3 | WTVJPPQWNLGGDF-UHFFFAOYSA-N | InChI=1S/C15H17N3O3/c1-11-7-5-6-10-17(11)14(19)13-15(20)21-16-18(13)12-8-3-2-4-9-12/h2-4,8-9,11H,5-7,10H2,1H3 | CC1CCCCN1C(=O)c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250392 | 287.314 | C15 H17 N3 O3 | XYEVVZCTKRHTSC-UHFFFAOYSA-N | InChI=1S/C15H17N3O3/c1-11-6-5-9-17(10-11)14(19)13-15(20)21-16-18(13)12-7-3-2-4-8-12/h2-4,7-8,11H,5-6,9-10H2,1H3 | CC1CCCN(C1)C(=O)c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250393 | 287.314 | C15 H17 N3 O3 | IACHZISEPDGUHQ-UHFFFAOYSA-N | InChI=1S/C15H17N3O3/c1-11-7-9-17(10-8-11)14(19)13-15(20)21-16-18(13)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3 | CC1CCN(CC1)C(=O)c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005214935 | 303.313 | C15 H17 N3 O4 | ICBXRWHFXQNWDU-UHFFFAOYSA-N | InChI=1S/C15H17N3O4/c1-10(19)14-15(16-11(2)20)22-17-18(14)9-8-12-6-4-5-7-13(12)21-3/h4-7H,8-9H2,1-3H3 | CC(=O)c1c(on[n+]1CCc2ccccc2OC)[N-]C(=O)C | |
| AKOS005250141 | 303.313 | C15 H17 N3 O4 | BTSOZFOPLQJRIB-UHFFFAOYSA-N | InChI=1S/C15H17N3O4/c1-21-12-8-6-11(7-9-12)18-13(15(20)22-17-18)14(19)16-10-4-2-3-5-10/h6-10H,2-5H2,1H3,(H-,16,17,19,20) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NC3CCCC3 | |
| AKOS005250266 | 303.313 | C15 H17 N3 O4 | MSJBHASHRCDZKR-UHFFFAOYSA-N | InChI=1S/C15H17N3O4/c1-17(14(19)10-3-4-10)9-13-15(20)22-16-18(13)11-5-7-12(21-2)8-6-11/h5-8,10H,3-4,9H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)C3CC3 | |
| AKOS005250344 | 303.313 | C15 H17 N3 O4 | YZEFOXNVZNXXJF-UHFFFAOYSA-N | InChI=1S/C15H17N3O4/c1-10(19)17(11-3-4-11)9-14-15(20)22-16-18(14)12-5-7-13(21-2)8-6-12/h5-8,11H,3-4,9H2,1-2H3 | CC(=O)N(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C3CC3 | |
| AKOS005250502 | 303.313 | C15 H17 N3 O4 | MYVWIBKXMNZKOG-UHFFFAOYSA-N | InChI=1S/C15H17N3O4/c1-10-8-17(9-11(2)21-10)14(19)13-15(20)22-16-18(13)12-6-4-3-5-7-12/h3-7,10-11H,8-9H2,1-2H3 | CC1CN(CC(O1)C)C(=O)c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250547 | 303.313 | C15 H17 N3 O4 | FBNISGZZLVFYRQ-UHFFFAOYSA-N | InChI=1S/C15H17N3O4/c1-21-12-7-5-11(6-8-12)18-13(15(20)22-16-18)14(19)17-9-3-2-4-10-17/h5-8H,2-4,9-10H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCCCC3 | |
| AKOS005252068 | 335.378 | C15 H17 N3 O4 S | YERGVHCNJXJZLV-UHFFFAOYSA-N | InChI=1S/C15H17N3O4S/c1-4-12(23-14-15(21)22-17-18(14)3)13(20)16-11-7-5-10(6-8-11)9(2)19/h5-8,12H,4H2,1-3H3,(H-,16,17,19,20,21) | CCC(C(=O)Nc1ccc(cc1)C(=O)C)Sc2c(on[n+]2C)[O-] | |
| AKOS005215705 | 319.313 | C15 H17 N3 O5 | DWPBXLUKTVGWIK-UHFFFAOYSA-N | InChI=1S/C15H17N3O5/c1-10(20)16-15-12(9-19)18(17-23-15)7-6-11-4-5-13(21-2)14(8-11)22-3/h4-5,8-9H,6-7H2,1-3H3 | CC(=O)[N-]c1c([n+](no1)CCc2ccc(c(c2)OC)OC)C=O | |
| AKOS005250173 | 319.313 | C15 H17 N3 O5 | NBYLBMPHSYPVDM-UHFFFAOYSA-N | InChI=1S/C15H17N3O5/c1-21-11-6-4-10(5-7-11)18-13(15(20)23-17-18)14(19)16-9-12-3-2-8-22-12/h4-7,12H,2-3,8-9H2,1H3,(H-,16,17,19,20) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCC3CCCO3 | |
| AKOS005250555 | 319.313 | C15 H17 N3 O5 | QSUBAQOTBPYPRG-UHFFFAOYSA-N | InChI=1S/C15H17N3O5/c1-22-12-4-2-10(3-5-12)18-13(15(21)23-16-18)14(20)17-8-6-11(19)7-9-17/h2-5,11,19H,6-9H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCC(CC3)O | |
| AKOS005250569 | 319.313 | C15 H17 N3 O5 | JINNABSNHJUGFT-UHFFFAOYSA-N | InChI=1S/C15H17N3O5/c1-3-4-9-22-14(20)10-5-7-11(8-6-10)16-13(19)12-15(21)23-17-18(12)2/h5-8H,3-4,9H2,1-2H3,(H-,16,17,19,20,21) | CCCCOC(=O)c1ccc(cc1)NC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005250104 | 351.378 | C15 H17 N3 O5 S | JGIWGXSQEMDDRL-UHFFFAOYSA-N | InChI=1S/C15H17N3O5S/c1-15(2)11(13(19)20)24-12(16-15)10-14(21)23-17-18(10)8-4-6-9(22-3)7-5-8/h4-7,11-12,16H,1-3H3,(H-,17,19,20,21) | CC1(C(SC(N1)c2c(on[n+]2c3ccc(cc3)OC)[O-])C(=O)O)C | |
| AKOS005250570 | 351.378 | C15 H17 N3 O5 S | NUAULDKCMHHGNH-UHFFFAOYSA-N | InChI=1S/C15H17N3O5S/c1-7-4-5-8-9(6-7)24-13(10(8)14(20)22-3)16-12(19)11-15(21)23-17-18(11)2/h7H,4-6H2,1-3H3,(H-,16,17,19,20,21) | CC1CCc2c(sc(c2C(=O)OC)NC(=O)c3c(on[n+]3C)[O-])C1 | |
| AKOS005250599 | 351.378 | C15 H17 N3 O5 S | LPLDRPCSPUOBCS-UHFFFAOYSA-N | InChI=1S/C15H17N3O5S/c1-3-22-14(20)10-8-6-4-5-7-9(8)24-13(10)16-12(19)11-15(21)23-17-18(11)2/h3-7H2,1-2H3,(H-,16,17,19,20,21) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3C)[O-])CCCC2 | |
| AKOS005250621 | 351.378 | C15 H17 N3 O5 S | GIPCUEWXRMSEFZ-UHFFFAOYSA-N | InChI=1S/C15H17N3O5S/c1-18-11(15(21)23-17-18)12(19)16-13-10(14(20)22-2)8-6-4-3-5-7-9(8)24-13/h3-7H2,1-2H3,(H-,16,17,19,20,21) | C[n+]1c(c(on1)[O-])C(=O)Nc2c(c3c(s2)CCCCC3)C(=O)OC | |
| AKOS005251453 | 351.378 | C15 H17 N3 O5 S | RKAYZUVAPWIWDT-UHFFFAOYSA-N | InChI=1S/C15H17N3O5S/c1-4-22-14(20)10-5-7-11(8-6-10)16-12(19)9(2)24-13-15(21)23-17-18(13)3/h5-9H,4H2,1-3H3,(H-,16,17,19,20,21) | CCOC(=O)c1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2C)[O-] | |
| AKOS005251905 | 351.378 | C15 H17 N3 O5 S | IFMWVMKSDWUSGM-UHFFFAOYSA-N | InChI=1S/C15H17N3O5S/c1-4-11(24-13-15(22)23-17-18(13)3)12(19)16-10-7-9(14(20)21)6-5-8(10)2/h5-7,11H,4H2,1-3H3,(H2-,16,17,19,20,21,22) | CCC(C(=O)Nc1cc(ccc1C)C(=O)O)Sc2c(on[n+]2C)[O-] | |
| AKOS005251919 | 351.378 | C15 H17 N3 O5 S | ROUTZLBMUROLEO-UHFFFAOYSA-N | InChI=1S/C15H17N3O5S/c1-3-12(24-14-15(20)23-17-18(14)2)13(19)16-9-4-5-10-11(8-9)22-7-6-21-10/h4-5,8,12H,3,6-7H2,1-2H3,(H-,16,17,19,20) | CCC(C(=O)Nc1ccc2c(c1)OCCO2)Sc3c(on[n+]3C)[O-] | |
| AKOS005252111 | 351.378 | C15 H17 N3 O5 S | YMWTZSAJFTUMDV-UHFFFAOYSA-N | InChI=1S/C15H17N3O5S/c1-4-11(24-13-15(21)23-17-18(13)2)12(19)16-10-8-6-5-7-9(10)14(20)22-3/h5-8,11H,4H2,1-3H3,(H-,16,17,19,20,21) | CCC(C(=O)Nc1ccccc1C(=O)OC)Sc2c(on[n+]2C)[O-] | |
| AKOS005252368 | 351.378 | C15 H17 N3 O5 S | YICUWDPWAIKWMM-UHFFFAOYSA-N | InChI=1S/C15H17N3O5S/c1-3-22-14(20)10-4-6-11(7-5-10)16-12(19)8-9-24-13-15(21)23-17-18(13)2/h4-7H,3,8-9H2,1-2H3,(H-,16,17,19,20,21) | CCOC(=O)c1ccc(cc1)NC(=O)CCSc2c(on[n+]2C)[O-] | |
| AKOS005251624 | 383.443 | C15 H17 N3 O5 S2 | KIZGGMXIZUQICQ-UHFFFAOYSA-N | InChI=1S/C15H17N3O5S2/c1-18-13(15(21)23-17-18)24-7-10(19)16-12-11(14(20)22-2)8-5-3-4-6-9(8)25-12/h3-7H2,1-2H3,(H-,16,17,19,20,21) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2c(c3c(s2)CCCC3)C(=O)OC | |
| AKOS005251928 | 367.377 | C15 H17 N3 O6 S | TYKOBZNYEICUHH-UHFFFAOYSA-N | InChI=1S/C15H17N3O6S/c1-4-11(25-13-15(22)24-17-18(13)2)12(19)16-9-6-5-8(14(20)21)7-10(9)23-3/h5-7,11H,4H2,1-3H3,(H2-,16,17,19,20,21,22) | CCC(C(=O)Nc1ccc(cc1OC)C(=O)O)Sc2c(on[n+]2C)[O-] | |
| AKOS005219468 | 331.393 | C15 H17 N5 O2 S | OBRBHLLUGVNORX-UHFFFAOYSA-N | InChI=1S/C15H17N5O2S/c1-9(2)20-7-14(22-19-20)18-13(21)8-23-15-12(6-16)5-10(3)11(4)17-15/h5,7,9H,8H2,1-4H3 | Cc1cc(c(nc1C)SCC(=O)[N-]c2c[n+](no2)C(C)C)C#N | |
| AKOS005219554 | 331.393 | C15 H17 N5 O2 S | MRUYETKJGDLWDS-UHFFFAOYSA-N | InChI=1S/C15H17N5O2S/c1-4-20-8-14(22-19-20)18-13(21)9-23-15-11(7-16)5-6-12(17-15)10(2)3/h5-6,8,10H,4,9H2,1-3H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)C(C)C)C#N | |
| AKOS005219555 | 331.393 | C15 H17 N5 O2 S | DNJKWDIGVQXNRR-UHFFFAOYSA-N | InChI=1S/C15H17N5O2S/c1-3-5-12-7-6-11(8-16)15(17-12)23-10-13(21)18-14-9-20(4-2)19-22-14/h6-7,9H,3-5,10H2,1-2H3 | CCCc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)CC)C#N | |
| AKOS005219568 | 331.393 | C15 H17 N5 O2 S | DWCFDKZTJRDULF-UHFFFAOYSA-N | InChI=1S/C15H17N5O2S/c1-10(2)6-12-5-4-11(7-16)15(17-12)23-9-13(21)18-14-8-20(3)19-22-14/h4-5,8,10H,6,9H2,1-3H3 | CC(C)Cc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)C)C#N | |
| AKOS005252429 | 331.393 | C15 H17 N5 O2 S | KZEGRQRITAKFND-UHFFFAOYSA-N | InChI=1S/C15H17N5O2S/c1-5-20-7-14(22-19-20)18-13(21)8-23-15-12(6-16)10(3)9(2)11(4)17-15/h7H,5,8H2,1-4H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)C)C)C)C#N | |
| AKOS005252529 | 331.393 | C15 H17 N5 O2 S | RLLMRIHYKPFHEO-UHFFFAOYSA-N | InChI=1S/C15H17N5O2S/c1-3-4-5-12-7-6-11(8-16)15(17-12)23-10-13(21)18-14-9-20(2)19-22-14/h6-7,9H,3-5,10H2,1-2H3 | CCCCc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)C)C#N | |
| AKOS005252860 | 331.393 | C15 H17 N5 O2 S | ICYAXSCQYWSUGU-UHFFFAOYSA-N | InChI=1S/C15H17N5O2S/c1-9(2)20-7-14(22-19-20)18-13(21)8-23-15-12(6-16)10(3)5-11(4)17-15/h5,7,9H,8H2,1-4H3 | Cc1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)C(C)C)C | |
| AKOS005253407 | 347.392 | C15 H17 N5 O3 S | UABWIAXUCIYYNP-UHFFFAOYSA-N | InChI=1S/C15H17N5O3S/c1-10-6-11(2)17-15(12(10)7-16)24-9-13(21)18-14-8-20(19-23-14)4-5-22-3/h6,8H,4-5,9H2,1-3H3 | Cc1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)CCOC)C | |
| AKOS005215017 | 339.774 | C15 H18 Cl N3 O4 | DQWCXLVYCCIHLR-UHFFFAOYSA-N | InChI=1S/C15H18ClN3O4/c1-10(20)17-15-12(9-16)19(18-23-15)7-6-11-4-5-13(21-2)14(8-11)22-3/h4-5,8H,6-7,9H2,1-3H3 | CC(=O)[N-]c1c([n+](no1)CCc2ccc(c(c2)OC)OC)CCl | |
| AKOS005252039 | 371.839 | C15 H18 Cl N3 O4 S | LKYVTOMXCGFTHV-UHFFFAOYSA-N | InChI=1S/C15H18ClN3O4S/c1-5-12(24-14-15(21)23-18-19(14)3)13(20)17-10-6-8(2)9(16)7-11(10)22-4/h6-7,12H,5H2,1-4H3,(H-,17,18,20,21) | CCC(C(=O)Nc1cc(c(cc1OC)Cl)C)Sc2c(on[n+]2C)[O-] | |
| AKOS005252083 | 387.839 | C15 H18 Cl N3 O5 S | WJULTVXXKZTPKV-UHFFFAOYSA-N | InChI=1S/C15H18ClN3O5S/c1-5-12(25-14-15(21)24-18-19(14)2)13(20)17-9-6-8(16)10(22-3)7-11(9)23-4/h6-7,12H,5H2,1-4H3,(H-,17,18,20,21) | CCC(C(=O)Nc1cc(c(cc1OC)OC)Cl)Sc2c(on[n+]2C)[O-] | |
| AKOS005219807 | 318.394 | C15 H18 N4 O2 S | AGYVHSKHZRVRGV-UHFFFAOYSA-N | InChI=1S/C15H18N4O2S/c1-18-13(14(20)21-17-18)10-19(15(22)16-12-7-8-12)9-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3,(H-,16,17,20,22) | C[n+]1c(c(on1)[O-])CN(Cc2ccccc2)C(=S)NC3CC3 | |
| AKOS005253050 | 318.394 | C15 H18 N4 O2 S | JLHDEGJBCHSGLI-UHFFFAOYSA-N | InChI=1S/C15H18N4O2S/c20-14(12-22-13-7-3-1-4-8-13)16-15-11-19(17-21-15)18-9-5-2-6-10-18/h1,3-4,7-8,11H,2,5-6,9-10,12H2 | c1ccc(cc1)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3 | |
| AKOS005250565 | 302.328 | C15 H18 N4 O3 | QZRNPDCTZQPWLT-UHFFFAOYSA-N | InChI=1S/C15H18N4O3/c1-2-17-8-10-18(11-9-17)14(20)13-15(21)22-16-19(13)12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3 | CCN1CCN(CC1)C(=O)c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005219789 | 334.393 | C15 H18 N4 O3 S | BHWQXGQBTZYIDN-UHFFFAOYSA-N | InChI=1S/C15H18N4O3S/c1-18(15(23)16-10-3-4-10)9-13-14(20)22-17-19(13)11-5-7-12(21-2)8-6-11/h5-8,10H,3-4,9H2,1-2H3,(H-,16,17,20,23) | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=S)NC3CC3 | |
| AKOS005252936 | 334.393 | C15 H18 N4 O3 S | RWPGBTSAYSALPK-UHFFFAOYSA-N | InChI=1S/C15H18N4O3S/c1-12-2-4-13(5-3-12)23-11-14(20)16-15-10-19(17-22-15)18-6-8-21-9-7-18/h2-5,10H,6-9,11H2,1H3 | Cc1ccc(cc1)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3 | |
| AKOS005253043 | 334.393 | C15 H18 N4 O3 S | VCLNIJQGKTUSOR-UHFFFAOYSA-N | InChI=1S/C15H18N4O3S/c20-14(12-23-11-13-4-2-1-3-5-13)16-15-10-19(17-22-15)18-6-8-21-9-7-18/h1-5,10H,6-9,11-12H2 | c1ccc(cc1)CSCC(=O)[N-]c2c[n+](no2)N3CCOCC3 | |
| AKOS005250496 | 318.328 | C15 H18 N4 O4 | BFWOWFSUTBZHIT-UHFFFAOYSA-N | InChI=1S/C15H18N4O4/c20-11-10-17-6-8-18(9-7-17)14(21)13-15(22)23-16-19(13)12-4-2-1-3-5-12/h1-5,20H,6-11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)CCO | |
| AKOS005250562 | 318.328 | C15 H18 N4 O4 | LAKVCOYTBDZIII-UHFFFAOYSA-N | InChI=1S/C15H18N4O4/c1-17-7-9-18(10-8-17)14(20)13-15(21)23-16-19(13)11-3-5-12(22-2)6-4-11/h3-6H,7-10H2,1-2H3 | CN1CCN(CC1)C(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250643 | 318.328 | C15 H18 N4 O4 | CISCBVPTUSEAQR-UHFFFAOYSA-N | InChI=1S/C15H18N4O4/c1-22-12-7-5-11(6-8-12)19-13(15(21)23-17-19)14(20)16-18-9-3-2-4-10-18/h5-8H,2-4,9-10H2,1H3,(H-,16,17,20,21) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NN3CCCCC3 | |
| AKOS005251996 | 350.393 | C15 H18 N4 O4 S | VRRAWOMEXQLXLK-UHFFFAOYSA-N | InChI=1S/C15H18N4O4S/c1-4-12(24-14-15(22)23-18-19(14)3)13(21)17-11-7-5-10(6-8-11)16-9(2)20/h5-8,12,18,22H,4H2,1-3H3 | CCC(C(=O)Nc1ccc(cc1)NC(=O)C)Sc2c(on[n+]2C)[O-] | |
| AKOS005250088 | 334.327 | C15 H18 N4 O5 | BQTFPUGCUMFOKM-UHFFFAOYSA-N | InChI=1S/C15H18N4O5/c1-17(8-12-15(23)24-16-18(12)2)13(20)9-19(10-14(21)22)11-6-4-3-5-7-11/h3-7H,8-10H2,1-2H3,(H-,16,21,22,23) | C[n+]1c(c(on1)[O-])CN(C)C(=O)CN(CC(=O)O)c2ccccc2 | |
| AKOS005252722 | 346.407 | C15 H18 N6 O2 S | NQQPXHZEQUBALA-UHFFFAOYSA-N | InChI=1S/C15H18N6O2S/c1-9-10(2)12(6-16)15(17-11(9)3)24-8-13(22)18-14-7-21(19-23-14)20(4)5/h7H,8H2,1-5H3 | Cc1c(c(c(nc1C)SCC(=O)[N-]c2c[n+](no2)N(C)C)C#N)C | |
| AKOS005252767 | 346.407 | C15 H18 N6 O2 S | HWCOBKJQKBKMFP-UHFFFAOYSA-N | InChI=1S/C15H18N6O2S/c1-10(2)12-6-5-11(7-16)15(17-12)24-9-13(22)18-14-8-21(19-23-14)20(3)4/h5-6,8,10H,9H2,1-4H3 | CC(C)c1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)N(C)C)C#N | |
| AKOS005252769 | 346.407 | C15 H18 N6 O2 S | HPAVVIXBMTVBQX-UHFFFAOYSA-N | InChI=1S/C15H18N6O2S/c1-4-5-12-7-6-11(8-16)15(17-12)24-10-13(22)18-14-9-21(19-23-14)20(2)3/h6-7,9H,4-5,10H2,1-3H3 | CCCc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)N(C)C)C#N | |
| AKOS005219480 | 330.342 | C15 H18 N6 O3 | QBXJQANUQJBWDR-UHFFFAOYSA-N | InChI=1S/C15H18N6O3/c1-15(2,3)14(22)18-13-12(8-11(9-16)10-17)21(19-24-13)20-4-6-23-7-5-20/h8H,4-7H2,1-3H3 | CC(C)(C)C(=O)[N-]c1c([n+](no1)N2CCOCC2)C=C(C#N)C#N | |
| AKOS005214329 | 273.33 | C15 H19 N3 O2 | ZGXKWJYGOXUKEH-UHFFFAOYSA-N | InChI=1S/C15H19N3O2/c19-15-14(11-16-12-7-3-1-4-8-12)18(17-20-15)13-9-5-2-6-10-13/h2,5-6,9-10,12,16H,1,3-4,7-8,11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CCCCC3 | |
| AKOS005214825 | 273.33 | C15 H19 N3 O2 | ZYHRDDHFWHFVGZ-UHFFFAOYSA-N | InChI=1S/C15H19N3O2/c1-11-6-8-13(9-7-11)18-14(15(19)20-17-18)10-16-12-4-2-3-5-12/h6-9,12,16H,2-5,10H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CCCC3 | |
| AKOS005214714 | 289.33 | C15 H19 N3 O3 | WJZWZOQOJMLLCE-UHFFFAOYSA-N | InChI=1S/C15H19N3O3/c1-11-4-6-12(7-5-11)18-14(15(19)21-17-18)10-16-9-13-3-2-8-20-13/h4-7,13,16H,2-3,8-10H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCC3CCCO3 | |
| AKOS005214822 | 289.33 | C15 H19 N3 O3 | WFONBOJTFMEREW-UHFFFAOYSA-N | InChI=1S/C15H19N3O3/c1-20-13-8-6-12(7-9-13)18-14(15(19)21-17-18)10-16-11-4-2-3-5-11/h6-9,11,16H,2-5,10H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CCCC3 | |
| AKOS005215616 | 289.33 | C15 H19 N3 O3 | JBYNWINYWSMFLG-UHFFFAOYSA-N | InChI=1S/C15H19N3O3/c1-11-5-7-12(8-6-11)9-18-10-13(21-17-18)16-14(19)20-15(2,3)4/h5-8,10H,9H2,1-4H3 | Cc1ccc(cc1)C[n+]2cc(on2)[N-]C(=O)OC(C)(C)C | |
| AKOS005215628 | 289.33 | C15 H19 N3 O3 | NBEUBVSPHBODFX-UHFFFAOYSA-N | InChI=1S/C15H19N3O3/c1-15(2,3)20-14(19)16-13-11-18(17-21-13)10-9-12-7-5-4-6-8-12/h4-8,11H,9-10H2,1-3H3 | CC(C)(C)OC(=O)[N-]c1c[n+](no1)CCc2ccccc2 | |
| AKOS005250359 | 289.33 | C15 H19 N3 O3 | ZQNZUOJIPWVXCH-UHFFFAOYSA-N | InChI=1S/C15H19N3O3/c1-3-4-10-14(19)17(2)11-13-15(20)21-16-18(13)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3 | CCCCC(=O)N(C)Cc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005251445 | 321.395 | C15 H19 N3 O3 S | HRDDCSVMEPDRGG-UHFFFAOYSA-N | InChI=1S/C15H19N3O3S/c1-9(2)11-5-7-12(8-6-11)16-13(19)10(3)22-14-15(20)21-17-18(14)4/h5-10H,1-4H3,(H-,16,17,19,20) | CC(C)c1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2C)[O-] | |
| AKOS005251492 | 321.395 | C15 H19 N3 O3 S | IGVCXWCZFCDMBU-UHFFFAOYSA-N | InChI=1S/C15H19N3O3S/c1-5-11-8-6-7-9(2)12(11)16-13(19)10(3)22-14-15(20)21-17-18(14)4/h6-8,10H,5H2,1-4H3,(H-,16,17,19,20) | CCc1cccc(c1NC(=O)C(C)Sc2c(on[n+]2C)[O-])C | |
| AKOS005252018 | 321.395 | C15 H19 N3 O3 S | WGYGYPFKJJTKQG-UHFFFAOYSA-N | InChI=1S/C15H19N3O3S/c1-5-12(22-14-15(20)21-17-18(14)4)13(19)16-11-8-9(2)6-7-10(11)3/h6-8,12H,5H2,1-4H3,(H-,16,17,19,20) | CCC(C(=O)Nc1cc(ccc1C)C)Sc2c(on[n+]2C)[O-] | |
| AKOS005252085 | 321.395 | C15 H19 N3 O3 S | UBPZMNUREYYJFM-UHFFFAOYSA-N | InChI=1S/C15H19N3O3S/c1-5-11(22-14-15(20)21-17-18(14)4)13(19)16-12-9(2)7-6-8-10(12)3/h6-8,11H,5H2,1-4H3,(H-,16,17,19,20) | CCC(C(=O)Nc1c(cccc1C)C)Sc2c(on[n+]2C)[O-] | |
| AKOS005252120 | 321.395 | C15 H19 N3 O3 S | OWFLZKDVQQBVJU-UHFFFAOYSA-N | InChI=1S/C15H19N3O3S/c1-5-12(22-14-15(20)21-17-18(14)4)13(19)16-11-8-6-7-9(2)10(11)3/h6-8,12H,5H2,1-4H3,(H-,16,17,19,20) | CCC(C(=O)Nc1cccc(c1C)C)Sc2c(on[n+]2C)[O-] | |
| AKOS005252129 | 321.395 | C15 H19 N3 O3 S | QCNMMZRSGBQFIR-UHFFFAOYSA-N | InChI=1S/C15H19N3O3S/c1-5-12(22-14-15(20)21-17-18(14)4)13(19)16-11-7-6-9(2)10(3)8-11/h6-8,12H,5H2,1-4H3,(H-,16,17,19,20) | CCC(C(=O)Nc1ccc(c(c1)C)C)Sc2c(on[n+]2C)[O-] | |
| AKOS005252135 | 321.395 | C15 H19 N3 O3 S | YBTNYDIGTXMTMT-UHFFFAOYSA-N | InChI=1S/C15H19N3O3S/c1-5-12(22-14-15(20)21-17-18(14)4)13(19)16-11-7-6-9(2)8-10(11)3/h6-8,12H,5H2,1-4H3,(H-,16,17,19,20) | CCC(C(=O)Nc1ccc(cc1C)C)Sc2c(on[n+]2C)[O-] | |
| AKOS005252138 | 321.395 | C15 H19 N3 O3 S | CKJULQHSDNZHBP-UHFFFAOYSA-N | InChI=1S/C15H19N3O3S/c1-5-12(22-14-15(20)21-17-18(14)4)13(19)16-11-7-9(2)6-10(3)8-11/h6-8,12H,5H2,1-4H3,(H-,16,17,19,20) | CCC(C(=O)Nc1cc(cc(c1)C)C)Sc2c(on[n+]2C)[O-] | |
| AKOS005252318 | 321.395 | C15 H19 N3 O3 S | DONRHJMJBIEQDV-UHFFFAOYSA-N | InChI=1S/C15H19N3O3S/c1-4-11-7-5-6-10(2)13(11)16-12(19)8-9-22-14-15(20)21-17-18(14)3/h5-7H,4,8-9H2,1-3H3,(H-,16,17,19,20) | CCc1cccc(c1NC(=O)CCSc2c(on[n+]2C)[O-])C | |
| AKOS005252360 | 321.395 | C15 H19 N3 O3 S | HIEUUTXLUYQOTP-UHFFFAOYSA-N | InChI=1S/C15H19N3O3S/c1-10(2)11-4-6-12(7-5-11)16-13(19)8-9-22-14-15(20)21-17-18(14)3/h4-7,10H,8-9H2,1-3H3,(H-,16,17,19,20) | CC(C)c1ccc(cc1)NC(=O)CCSc2c(on[n+]2C)[O-] | |
| AKOS005214712 | 305.329 | C15 H19 N3 O4 | LSZIWUBGGXOXHV-UHFFFAOYSA-N | InChI=1S/C15H19N3O4/c1-20-12-6-4-11(5-7-12)18-14(15(19)22-17-18)10-16-9-13-3-2-8-21-13/h4-7,13,16H,2-3,8-10H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCC3CCCO3 | |
| AKOS005215074 | 305.329 | C15 H19 N3 O4 | LSWOWQVUCQYNPY-UHFFFAOYSA-N | InChI=1S/C15H19N3O4/c1-10(19)14-15(16-11(2)20)22-17-18(14)9-8-12-6-4-5-7-13(12)21-3/h4-7,10,19H,8-9H2,1-3H3 | CC(c1c(on[n+]1CCc2ccccc2OC)[N-]C(=O)C)O | |
| AKOS005215617 | 305.329 | C15 H19 N3 O4 | CESZZJKMWAPXAV-UHFFFAOYSA-N | InChI=1S/C15H19N3O4/c1-15(2,3)21-14(19)16-13-10-18(17-22-13)9-11-5-7-12(20-4)8-6-11/h5-8,10H,9H2,1-4H3 | CC(C)(C)OC(=O)[N-]c1c[n+](no1)Cc2ccc(cc2)OC | |
| AKOS005250159 | 305.329 | C15 H19 N3 O4 | WAXNKENDMABQEC-UHFFFAOYSA-N | InChI=1S/C15H19N3O4/c1-5-15(2,3)16-13(19)12-14(20)22-17-18(12)10-6-8-11(21-4)9-7-10/h6-9H,5H2,1-4H3,(H-,16,17,19,20) | CCC(C)(C)NC(=O)c1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005250267 | 305.329 | C15 H19 N3 O4 | IMMZLSHSCXVPNY-UHFFFAOYSA-N | InChI=1S/C15H19N3O4/c1-4-5-14(19)17(2)10-13-15(20)22-16-18(13)11-6-8-12(21-3)9-7-11/h6-9H,4-5,10H2,1-3H3 | CCCC(=O)N(C)Cc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005251113 | 337.394 | C15 H19 N3 O4 S | NHEJUFNUCRGLLW-UHFFFAOYSA-N | InChI=1S/C15H19N3O4S/c1-3-4-9-21-12-7-5-11(6-8-12)16-13(19)10-23-14-15(20)22-17-18(14)2/h5-8H,3-4,9-10H2,1-2H3,(H-,16,17,19,20) | CCCCOc1ccc(cc1)NC(=O)CSc2c(on[n+]2C)[O-] | |
| AKOS005252081 | 337.394 | C15 H19 N3 O4 S | SBZYUERUVJJZPS-UHFFFAOYSA-N | InChI=1S/C15H19N3O4S/c1-4-12(23-14-15(20)22-17-18(14)3)13(19)16-10-6-8-11(9-7-10)21-5-2/h6-9,12H,4-5H2,1-3H3,(H-,16,17,19,20) | CCC(C(=O)Nc1ccc(cc1)OCC)Sc2c(on[n+]2C)[O-] | |
| AKOS005252114 | 337.394 | C15 H19 N3 O4 S | BUPALWINWJUHRT-UHFFFAOYSA-N | InChI=1S/C15H19N3O4S/c1-4-12(23-14-15(20)22-17-18(14)3)13(19)16-10-8-6-7-9-11(10)21-5-2/h6-9,12H,4-5H2,1-3H3,(H-,16,17,19,20) | CCC(C(=O)Nc1ccccc1OCC)Sc2c(on[n+]2C)[O-] | |
| AKOS005215585 | 321.328 | C15 H19 N3 O5 | OUJVPWBHUSOVCL-UHFFFAOYSA-N | InChI=1S/C15H19N3O5/c1-17(9-8-14(19)22-3)10-13-15(20)23-16-18(13)11-4-6-12(21-2)7-5-11/h4-7H,8-10H2,1-3H3 | CN(CCC(=O)OC)Cc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005215626 | 321.328 | C15 H19 N3 O5 | STKBSNAJRGXILG-UHFFFAOYSA-N | InChI=1S/C15H19N3O5/c1-10(20)16-15-12(9-19)18(17-23-15)7-6-11-4-5-13(21-2)14(8-11)22-3/h4-5,8,19H,6-7,9H2,1-3H3 | CC(=O)[N-]c1c([n+](no1)CCc2ccc(c(c2)OC)OC)CO | |
| AKOS005250215 | 321.328 | C15 H19 N3 O5 | CFYWBQMANYHDNV-UHFFFAOYSA-N | InChI=1S/C15H19N3O5/c1-3-22-10-4-9-16-14(19)13-15(20)23-17-18(13)11-5-7-12(21-2)8-6-11/h5-8H,3-4,9-10H2,1-2H3,(H-,16,17,19,20) | CCOCCCNC(=O)c1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005252046 | 353.393 | C15 H19 N3 O5 S | VQCFJNMEEWZESF-UHFFFAOYSA-N | InChI=1S/C15H19N3O5S/c1-5-12(24-14-15(20)23-17-18(14)2)13(19)16-10-7-6-9(21-3)8-11(10)22-4/h6-8,12H,5H2,1-4H3,(H-,16,17,19,20) | CCC(C(=O)Nc1ccc(cc1OC)OC)Sc2c(on[n+]2C)[O-] | |
| AKOS005252061 | 353.393 | C15 H19 N3 O5 S | CUGIUUYCNQWHFC-UHFFFAOYSA-N | InChI=1S/C15H19N3O5S/c1-5-12(24-14-15(20)23-17-18(14)2)13(19)16-10-8-9(21-3)6-7-11(10)22-4/h6-8,12H,5H2,1-4H3,(H-,16,17,19,20) | CCC(C(=O)Nc1cc(ccc1OC)OC)Sc2c(on[n+]2C)[O-] | |
| AKOS005252070 | 353.393 | C15 H19 N3 O5 S | NDLRLNYDSCYFEM-UHFFFAOYSA-N | InChI=1S/C15H19N3O5S/c1-5-12(24-14-15(20)23-17-18(14)2)13(19)16-9-6-10(21-3)8-11(7-9)22-4/h6-8,12H,5H2,1-4H3,(H-,16,17,19,20) | CCC(C(=O)Nc1cc(cc(c1)OC)OC)Sc2c(on[n+]2C)[O-] | |
| AKOS005253123 | 333.409 | C15 H19 N5 O2 S | QLFJHSLCOPUBHT-UHFFFAOYSA-N | InChI=1S/C15H19N5O2S/c16-12-5-4-6-13(9-12)23-11-14(21)17-15-10-20(18-22-15)19-7-2-1-3-8-19/h4-6,9-10H,1-3,7-8,11,16H2 | c1cc(cc(c1)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3)N | |
| AKOS005214786 | 288.345 | C15 H20 N4 O2 | WXEUNMOESYIBBD-UHFFFAOYSA-N | InChI=1S/C15H20N4O2/c1-12-5-7-13(8-6-12)19-14(15(20)21-17-19)11-16-18-9-3-2-4-10-18/h5-8,16H,2-4,9-11H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNN3CCCCC3 | |
| AKOS005214226 | 304.344 | C15 H20 N4 O3 | VBTRTKMPJUVVCN-UHFFFAOYSA-N | InChI=1S/C15H20N4O3/c20-15-14(12-16-6-7-18-8-10-21-11-9-18)19(17-22-15)13-4-2-1-3-5-13/h1-5,16H,6-12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCCN3CCOCC3 | |
| AKOS005214804 | 304.344 | C15 H20 N4 O3 | CMXSCAOONHGPAG-UHFFFAOYSA-N | InChI=1S/C15H20N4O3/c1-21-13-7-5-12(6-8-13)19-14(15(20)22-17-19)11-16-18-9-3-2-4-10-18/h5-8,16H,2-4,9-11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNN3CCCCC3 | |
| AKOS005214985 | 304.344 | C15 H20 N4 O3 | KRTHOKBHOUEHSI-UHFFFAOYSA-N | InChI=1S/C15H20N4O3/c1-11(20)17-15-13(10-16-2)19(18-22-15)9-8-12-6-4-5-7-14(12)21-3/h4-7,16H,8-10H2,1-3H3 | CC(=O)[N-]c1c([n+](no1)CCc2ccccc2OC)CNC | |
| AKOS005214879 | 320.344 | C15 H20 N4 O4 | UBCLOTFZMLDNRX-UHFFFAOYSA-N | InChI=1S/C15H20N4O4/c1-10(20)17-15-12(9-16)19(18-23-15)7-6-11-4-5-13(21-2)14(8-11)22-3/h4-5,8H,6-7,9,16H2,1-3H3 | CC(=O)[N-]c1c([n+](no1)CCc2ccc(c(c2)OC)OC)CN | |
| AKOS005250654 | 320.344 | C15 H20 N4 O4 | BYFFHZBUPHFBBI-UHFFFAOYSA-N | InChI=1S/C15H20N4O4/c1-18(2)10-4-9-16-14(20)13-15(21)23-17-19(13)11-5-7-12(22-3)8-6-11/h5-8H,4,9-10H2,1-3H3,(H-,16,17,20,21) | CN(C)CCCNC(=O)c1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005253140 | 348.423 | C15 H20 N6 O2 S | VHGOTZMJBULGJZ-UHFFFAOYSA-N | InChI=1S/C15H20N6O2S/c1-11-8-12(2)17-15(16-11)24-10-13(22)18-14-9-21(19-23-14)20-6-4-3-5-7-20/h8-9H,3-7,10H2,1-2H3 | Cc1cc(nc(n1)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3)C | |
| AKOS005214735 | 275.346 | C15 H21 N3 O2 | OEEGIDAZGIJLMD-UHFFFAOYSA-N | InChI=1S/C15H21N3O2/c1-5-15(3,4)16-10-13-14(19)20-17-18(13)12-8-6-11(2)7-9-12/h6-9,16H,5,10H2,1-4H3 | CCC(C)(C)NCc1c(on[n+]1c2ccc(cc2)C)[O-] | |
| AKOS005214279 | 291.346 | C15 H21 N3 O3 | RTQYXLQDEWMJQM-UHFFFAOYSA-N | InChI=1S/C15H21N3O3/c1-11(2)18-14(15(19)21-17-18)10-16-9-8-12-4-6-13(20-3)7-5-12/h4-7,11,16H,8-10H2,1-3H3 | CC(C)[n+]1c(c(on1)[O-])CNCCc2ccc(cc2)OC | |
| AKOS005214302 | 291.346 | C15 H21 N3 O3 | USIOOKGWIHKEEC-UHFFFAOYSA-N | InChI=1S/C15H21N3O3/c1-11(2)18-13(15(19)21-17-18)10-16-9-8-12-6-4-5-7-14(12)20-3/h4-7,11,16H,8-10H2,1-3H3 | CC(C)[n+]1c(c(on1)[O-])CNCCc2ccccc2OC | |
| AKOS005214733 | 291.346 | C15 H21 N3 O3 | HAQJMXYRQHVBKW-UHFFFAOYSA-N | InChI=1S/C15H21N3O3/c1-5-15(2,3)16-10-13-14(19)21-17-18(13)11-6-8-12(20-4)9-7-11/h6-9,16H,5,10H2,1-4H3 | CCC(C)(C)NCc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005214855 | 291.346 | C15 H21 N3 O3 | GGHANPQBRDVCCE-UHFFFAOYSA-N | InChI=1S/C15H21N3O3/c1-3-20-10-4-9-16-11-14-15(19)21-17-18(14)13-7-5-12(2)6-8-13/h5-8,16H,3-4,9-11H2,1-2H3 | CCOCCCNCc1c(on[n+]1c2ccc(cc2)C)[O-] | |
| AKOS005214852 | 307.345 | C15 H21 N3 O4 | BEBMHBRXPGXHJQ-UHFFFAOYSA-N | InChI=1S/C15H21N3O4/c1-3-21-10-4-9-16-11-14-15(19)22-17-18(14)12-5-7-13(20-2)8-6-12/h5-8,16H,3-4,9-11H2,1-2H3 | CCOCCCNCc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005253122 | 335.425 | C15 H21 N5 O2 S | LZYHAKAABPSQRV-UHFFFAOYSA-N | InChI=1S/C15H21N5O2S/c16-12-4-6-13(7-5-12)23-11-14(21)17-15-10-20(18-22-15)19-8-2-1-3-9-19/h4,6,10H,1-3,5,7-9,11,16H2 | c1c(on[n+]1N2CCCCC2)[N-]C(=O)CSC3=CC=C(CC3)N | |
| AKOS005215546 | 319.359 | C15 H21 N5 O3 | QFEGVQSHEXQVHE-UHFFFAOYSA-N | InChI=1S/C15H21N5O3/c1-10(21)16-15-13(20(17-23-15)19(4)5)14(22)11-6-8-12(9-7-11)18(2)3/h6-9,14,22H,1-5H3 | CC(=O)[N-]c1c([n+](no1)N(C)C)C(c2ccc(cc2)N(C)C)O | |
| AKOS005214796 | 290.361 | C15 H22 N4 O2 | QZFSITXBEAOOLQ-UHFFFAOYSA-N | InChI=1S/C15H22N4O2/c1-12-5-7-13(8-6-12)19-14(15(20)21-17-19)11-16-9-4-10-18(2)3/h5-8,16H,4,9-11H2,1-3H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCCN(C)C | |
| AKOS005214813 | 306.36 | C15 H22 N4 O3 | DYZVMTYBBLBAIO-UHFFFAOYSA-N | InChI=1S/C15H22N4O3/c1-18(2)10-4-9-16-11-14-15(20)22-17-19(14)12-5-7-13(21-3)8-6-12/h5-8,16H,4,9-11H2,1-3H3 | CN(C)CCCNCc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005253147 | 324.442 | C15 H24 N4 O2 S | SPAVHQOLDQLTGD-UHFFFAOYSA-N | InChI=1S/C15H24N4O2S/c20-14(12-22-13-7-3-1-4-8-13)16-15-11-19(17-21-15)18-9-5-2-6-10-18/h11,13H,1-10,12H2 | c1c(on[n+]1N2CCCCC2)[N-]C(=O)CSC3CCCCC3 | |
| AKOS005215703 | 378.201 | C15 H5 F7 N2 O2 | FPFVQROFTOLVLY-UHFFFAOYSA-N | InChI=1S/C15H5F7N2O2/c16-9-7(10(17)12(19)8(11(9)18)15(20,21)22)13-14(25)26-23-24(13)6-4-2-1-3-5-6/h1-5H | c1ccc(cc1)[n+]2c(c(on2)[O-])c3c(c(c(c(c3F)F)C(F)(F)F)F)F | |
| AKOS005215622 | 345.148 | C15 H9 Br N2 O3 | CPSAYVGZOZLBRV-UHFFFAOYSA-N | InChI=1S/C15H9BrN2O3/c16-12-9-5-4-8-11(12)14(19)13-15(20)21-17-18(13)10-6-2-1-3-7-10/h1-9H | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3ccccc3Br | MFCD09881660 |
| AKOS005215675 | 263.251 | C15 H9 N3 O2 | XKTXYCMSPWHTFI-UHFFFAOYSA-N | InChI=1S/C15H9N3O2/c19-15-14(10-9-12-6-4-5-11-16-12)18(17-20-15)13-7-2-1-3-8-13/h1-8,11H | c1ccc(cc1)[n+]2c(c(on2)[O-])C#Cc3ccccn3 | MFCD09881644 |
| AKOS005250398 | 359.787 | C16 H10 Cl N3 O3 S | ZYXNLXKJKFAIEN-UHFFFAOYSA-N | InChI=1S/C16H10ClN3O3S/c1-19-14(16(22)23-18-19)15(21)20-10-4-2-3-5-12(10)24-13-7-6-9(17)8-11(13)20/h2-8H,1H3 | C[n+]1c(c(on1)[O-])C(=O)N2c3ccccc3Sc4c2cc(cc4)Cl | |
| AKOS005252535 | 425.408 | C16 H10 F3 N5 O2 S2 | DDJGIGOPJAZJKI-UHFFFAOYSA-N | InChI=1S/C16H10F3N5O2S2/c1-24-7-14(26-23-24)22-13(25)8-28-15-9(6-20)10(16(17,18)19)5-11(21-15)12-3-2-4-27-12/h2-5,7H,8H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3cccs3)C(F)(F)F)C#N | |
| AKOS005215677 | 262.263 | C16 H10 N2 O2 | OIXIYRHQIAOQLW-UHFFFAOYSA-N | InChI=1S/C16H10N2O2/c19-16-15(12-11-13-7-3-1-4-8-13)18(17-20-16)14-9-5-2-6-10-14/h1-10H | c1ccc(cc1)C#Cc2c(on[n+]2c3ccccc3)[O-] | MFCD09881640 |
| AKOS005215689 | 294.262 | C16 H10 N2 O4 | IJSRENVCUGCMQG-UHFFFAOYSA-N | InChI=1S/C16H10N2O4/c1-11-9-12(10-15(19)21-11)7-8-14-16(20)22-17-18(14)13-5-3-2-4-6-13/h2-6,9-10H,1H3 | Cc1cc(cc(=O)o1)C#Cc2c(on[n+]2c3ccccc3)[O-] | MFCD09881645 |
| AKOS005215663 | 322.275 | C16 H10 N4 O4 | XGSQVLQCUQPRNQ-UHFFFAOYSA-N | InChI=1S/C16H10N4O4/c21-15-13(19(17-23-15)11-7-3-1-4-8-11)14-16(22)24-18-20(14)12-9-5-2-6-10-12/h1-10H | c1ccc(cc1)[n+]2c(c(on2)[O-])c3c(on[n+]3c4ccccc4)[O-] | MFCD09881658 |
| AKOS005250698 | 398.419 | C16 H10 N6 O3 S2 | DZMPMFGOFSLTSA-UHFFFAOYSA-N | InChI=1S/C16H10N6O3S2/c1-22-13(16(24)25-21-22)10(23)7-27-15-9(6-18)12(11-3-2-4-26-11)8(5-17)14(19)20-15/h2-4H,7H2,1H3,(H2-,19,20,21,23,24) | C[n+]1c(c(on1)[O-])C(=O)CSc2c(c(c(c(n2)N)C#N)c3cccs3)C#N | |
| AKOS005253792 | 398.419 | C16 H10 N6 O3 S2 | AZLAIRILQXLAFW-UHFFFAOYSA-N | InChI=1S/C16H10N6O3S2/c1-22-11(16(24)25-21-22)12(23)13-10(18)9-8(6-2-3-26-5-6)7(4-17)14(19)20-15(9)27-13/h2-3,5H,1H3,(H4-,18,19,20,21,23,24) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4ccsc4)N | |
| AKOS005253866 | 398.419 | C16 H10 N6 O3 S2 | LVMMJBQNOIDNEW-UHFFFAOYSA-N | InChI=1S/C16H10N6O3S2/c1-22-11(16(24)25-21-22)12(23)13-10(18)9-8(7-3-2-4-26-7)6(5-17)14(19)20-15(9)27-13/h2-4H,1H3,(H4-,18,19,20,21,23,24) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4cccs4)N | |
| AKOS005250705 | 382.353 | C16 H10 N6 O4 S | BLKGDCYFTBSFHK-UHFFFAOYSA-N | InChI=1S/C16H10N6O4S/c1-22-13(16(24)26-21-22)10(23)7-27-15-9(6-18)12(11-3-2-4-25-11)8(5-17)14(19)20-15/h2-4H,7H2,1H3,(H2-,19,20,21,23,24) | C[n+]1c(c(on1)[O-])C(=O)CSc2c(c(c(c(n2)N)C#N)c3ccco3)C#N | |
| AKOS005253843 | 382.353 | C16 H10 N6 O4 S | YMOQDVYHCWACRZ-UHFFFAOYSA-N | InChI=1S/C16H10N6O4S/c1-22-11(16(24)26-21-22)12(23)13-10(18)9-8(7-3-2-4-25-7)6(5-17)14(19)20-15(9)27-13/h2-4H,1H3,(H4-,18,19,20,21,23,24) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4ccco4)N | |
| AKOS005251137 | 424.244 | C16 H11 Br F N3 O3 S | FMRWUHBTQHNRQE-UHFFFAOYSA-N | InChI=1S/C16H11BrFN3O3S/c17-10-6-7-13(12(18)8-10)19-14(22)9-25-15-16(23)24-20-21(15)11-4-2-1-3-5-11/h1-8H,9H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3F)Br | |
| AKOS005250229 | 408.179 | C16 H11 Br F N3 O4 | HAXQKZHXXPTQJO-UHFFFAOYSA-N | InChI=1S/C16H11BrFN3O4/c1-24-11-5-3-10(4-6-11)21-14(16(23)25-20-21)15(22)19-13-7-2-9(17)8-12(13)18/h2-8H,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(cc3F)Br | |
| AKOS005251149 | 379.793 | C16 H11 Cl F N3 O3 S | ZRIPPFFFEBNMIW-UHFFFAOYSA-N | InChI=1S/C16H11ClFN3O3S/c17-12-8-10(6-7-13(12)18)19-14(22)9-25-15-16(23)24-20-21(15)11-4-2-1-3-5-11/h1-8H,9H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(c(c3)Cl)F | |
| AKOS005250116 | 363.728 | C16 H11 Cl F N3 O4 | WTLHOKXQUNRGIX-UHFFFAOYSA-N | InChI=1S/C16H11ClFN3O4/c1-24-11-5-3-10(4-6-11)21-14(16(23)25-20-21)15(22)19-9-2-7-13(18)12(17)8-9/h2-8H,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(c(c3)Cl)F | |
| AKOS005219520 | 346.788 | C16 H11 Cl N2 O3 S | IHCOBAJTEGYZDA-UHFFFAOYSA-N | InChI=1S/C16H11ClN2O3S/c17-11-6-8-13(9-7-11)23-10-14(20)15-16(21)22-18-19(15)12-4-2-1-3-5-12/h1-9H,10H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3ccc(cc3)Cl | |
| AKOS005251165 | 396.248 | C16 H11 Cl2 N3 O3 S | SIOMUTKXZNSOLB-UHFFFAOYSA-N | InChI=1S/C16H11Cl2N3O3S/c17-11-7-4-8-12(14(11)18)19-13(22)9-25-15-16(23)24-20-21(15)10-5-2-1-3-6-10/h1-8H,9H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cccc(c3Cl)Cl | |
| AKOS005251166 | 396.248 | C16 H11 Cl2 N3 O3 S | ZCFRLEYBUGNUCC-UHFFFAOYSA-N | InChI=1S/C16H11Cl2N3O3S/c17-10-6-7-13(12(18)8-10)19-14(22)9-25-15-16(23)24-20-21(15)11-4-2-1-3-5-11/h1-8H,9H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3Cl)Cl | |
| AKOS005251173 | 396.248 | C16 H11 Cl2 N3 O3 S | QTUZUJGQSOQFBX-UHFFFAOYSA-N | InChI=1S/C16H11Cl2N3O3S/c17-10-6-7-12(18)13(8-10)19-14(22)9-25-15-16(23)24-20-21(15)11-4-2-1-3-5-11/h1-8H,9H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cc(ccc3Cl)Cl | |
| AKOS005251174 | 396.248 | C16 H11 Cl2 N3 O3 S | LVCGOALPYYWCSM-UHFFFAOYSA-N | InChI=1S/C16H11Cl2N3O3S/c17-12-7-6-10(8-13(12)18)19-14(22)9-25-15-16(23)24-20-21(15)11-4-2-1-3-5-11/h1-8H,9H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(c(c3)Cl)Cl | |
| AKOS005251181 | 396.248 | C16 H11 Cl2 N3 O3 S | YLUGNFYUJXQKLL-UHFFFAOYSA-N | InChI=1S/C16H11Cl2N3O3S/c17-10-6-11(18)8-12(7-10)19-14(22)9-25-15-16(23)24-20-21(15)13-4-2-1-3-5-13/h1-8H,9H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cc(cc(c3)Cl)Cl | |
| AKOS005250118 | 380.182 | C16 H11 Cl2 N3 O4 | NKVZALYPHYEQQB-UHFFFAOYSA-N | InChI=1S/C16H11Cl2N3O4/c1-24-13-4-2-12(3-5-13)21-14(16(23)25-20-21)15(22)19-11-7-9(17)6-10(18)8-11/h2-8H,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3cc(cc(c3)Cl)Cl | |
| AKOS005250230 | 380.182 | C16 H11 Cl2 N3 O4 | ZQIFSIWIPABFAM-UHFFFAOYSA-N | InChI=1S/C16H11Cl2N3O4/c1-24-10-7-5-9(6-8-10)21-14(16(23)25-20-21)15(22)19-12-4-2-3-11(17)13(12)18/h2-8H,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3cccc(c3Cl)Cl | |
| AKOS005250231 | 380.182 | C16 H11 Cl2 N3 O4 | JGUZGMCXCRYLIO-UHFFFAOYSA-N | InChI=1S/C16H11Cl2N3O4/c1-24-11-5-3-10(4-6-11)21-14(16(23)25-20-21)15(22)19-13-7-2-9(17)8-12(13)18/h2-8H,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(cc3Cl)Cl | |
| AKOS005250239 | 380.182 | C16 H11 Cl2 N3 O4 | FYPOBTDEPCUTMR-UHFFFAOYSA-N | InChI=1S/C16H11Cl2N3O4/c1-24-11-5-3-10(4-6-11)21-14(16(23)25-20-21)15(22)19-13-8-9(17)2-7-12(13)18/h2-8H,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3cc(ccc3Cl)Cl | |
| AKOS005250240 | 380.182 | C16 H11 Cl2 N3 O4 | MQZWCOSJXYXBQR-UHFFFAOYSA-N | InChI=1S/C16H11Cl2N3O4/c1-24-11-5-3-10(4-6-11)21-14(16(23)25-20-21)15(22)19-9-2-7-12(17)13(18)8-9/h2-8H,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(c(c3)Cl)Cl | |
| AKOS005251180 | 363.339 | C16 H11 F2 N3 O3 S | KFKBYZKHYJRHOP-UHFFFAOYSA-N | InChI=1S/C16H11F2N3O3S/c17-12-7-6-10(8-13(12)18)19-14(22)9-25-15-16(23)24-20-21(15)11-4-2-1-3-5-11/h1-8H,9H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(c(c3)F)F | |
| AKOS005250170 | 347.273 | C16 H11 F2 N3 O4 | MXNBLSWMAUGDBF-UHFFFAOYSA-N | InChI=1S/C16H11F2N3O4/c1-24-11-5-3-10(4-6-11)21-14(16(23)25-20-21)15(22)19-9-2-7-12(17)13(18)8-9/h2-8H,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(c(c3)F)F | |
| AKOS005250395 | 325.342 | C16 H11 N3 O3 S | QFQAOCRLQDWOEW-UHFFFAOYSA-N | InChI=1S/C16H11N3O3S/c1-18-14(16(21)22-17-18)15(20)19-10-6-2-4-8-12(10)23-13-9-5-3-7-11(13)19/h2-9H,1H3 | C[n+]1c(c(on1)[O-])C(=O)N2c3ccccc3Sc4c2cccc4 | |
| AKOS005251205 | 371.347 | C16 H11 N4 O5 S | JNQQLYSBKQQWJV-UHFFFAOYSA-M | InChI=1S/C16H12N4O5S/c21-14(17-11-6-8-13(9-7-11)20(23)24)10-26-15-16(22)25-18-19(15)12-4-2-1-3-5-12/h1-6,8-9,22H,10H2,(H,17,21)/p-1 | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(c[c-]3)[N+](=O)[O-] | |
| AKOS005250241 | 355.282 | C16 H11 N4 O6 | VSJZQOPKGOOPRB-UHFFFAOYSA-M | InChI=1S/C16H12N4O6/c1-25-13-8-6-11(7-9-13)19-14(16(22)26-18-19)15(21)17-10-2-4-12(5-3-10)20(23)24/h2,4-9,22H,1H3,(H,17,21)/p-1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(c[c-]3)[N+](=O)[O-] | |
| AKOS005252415 | 397.434 | C16 H11 N7 O2 S2 | NBMOIELSDKUUGY-UHFFFAOYSA-N | InChI=1S/C16H11N7O2S2/c1-23-7-13(25-22-23)20-12(24)8-27-16-10(6-18)14(11-3-2-4-26-11)9(5-17)15(19)21-16/h2-4,7H,8H2,1H3,(H2-,19,20,21,22,24) | C[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3cccs3)C#N | |
| AKOS005252416 | 381.369 | C16 H11 N7 O3 S | FYCVWZICCRRUNQ-UHFFFAOYSA-N | InChI=1S/C16H11N7O3S/c1-23-7-13(26-22-23)20-12(24)8-27-16-10(6-18)14(11-3-2-4-25-11)9(5-17)15(19)21-16/h2-4,7H,8H2,1H3,(H2-,19,20,21,22,24) | C[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3ccco3)C#N | |
| AKOS005251135 | 406.254 | C16 H12 Br N3 O3 S | KGIKYTBGFCDCAN-UHFFFAOYSA-N | InChI=1S/C16H12BrN3O3S/c17-12-8-4-5-9-13(12)18-14(21)10-24-15-16(22)23-19-20(15)11-6-2-1-3-7-11/h1-9H,10H2,(H-,18,19,21,22) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccccc3Br | |
| AKOS005251136 | 406.254 | C16 H12 Br N3 O3 S | SSZAJGXGEVXQNR-UHFFFAOYSA-N | InChI=1S/C16H12BrN3O3S/c17-11-6-8-12(9-7-11)18-14(21)10-24-15-16(22)23-19-20(15)13-4-2-1-3-5-13/h1-9H,10H2,(H-,18,19,21,22) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)Br | |
| AKOS005250221 | 390.188 | C16 H12 Br N3 O4 | XWBVFHAZYSMROK-UHFFFAOYSA-N | InChI=1S/C16H12BrN3O4/c1-23-11-8-6-10(7-9-11)20-14(16(22)24-19-20)15(21)18-13-5-3-2-4-12(13)17/h2-9H,1H3,(H-,18,19,21,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccccc3Br | |
| AKOS005250228 | 390.188 | C16 H12 Br N3 O4 | PMBQVEJGAAIDFG-UHFFFAOYSA-N | InChI=1S/C16H12BrN3O4/c1-23-13-8-6-12(7-9-13)20-14(16(22)24-19-20)15(21)18-11-4-2-10(17)3-5-11/h2-9H,1H3,(H-,18,19,21,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(cc3)Br | |
| AKOS005251140 | 361.803 | C16 H12 Cl N3 O3 S | PHRHNLDYOSBYAN-UHFFFAOYSA-N | InChI=1S/C16H12ClN3O3S/c17-12-8-4-5-9-13(12)18-14(21)10-24-15-16(22)23-19-20(15)11-6-2-1-3-7-11/h1-9H,10H2,(H-,18,19,21,22) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccccc3Cl | |
| AKOS005251141 | 361.803 | C16 H12 Cl N3 O3 S | DPFAYPUZMSPGOM-UHFFFAOYSA-N | InChI=1S/C16H12ClN3O3S/c17-11-5-4-6-12(9-11)18-14(21)10-24-15-16(22)23-19-20(15)13-7-2-1-3-8-13/h1-9H,10H2,(H-,18,19,21,22) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cccc(c3)Cl | |
| AKOS005251142 | 361.803 | C16 H12 Cl N3 O3 S | OYRNJMOJQBXQFP-UHFFFAOYSA-N | InChI=1S/C16H12ClN3O3S/c17-11-6-8-12(9-7-11)18-14(21)10-24-15-16(22)23-19-20(15)13-4-2-1-3-5-13/h1-9H,10H2,(H-,18,19,21,22) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)Cl | |
| AKOS005250236 | 345.737 | C16 H12 Cl N3 O4 | NCOGBYPKRIHOOO-UHFFFAOYSA-N | InChI=1S/C16H12ClN3O4/c1-23-11-8-6-10(7-9-11)20-14(16(22)24-19-20)15(21)18-13-5-3-2-4-12(13)17/h2-9H,1H3,(H-,18,19,21,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccccc3Cl | |
| AKOS005250237 | 345.737 | C16 H12 Cl N3 O4 | MMXXNPITMVCKEC-UHFFFAOYSA-N | InChI=1S/C16H12ClN3O4/c1-23-13-7-5-12(6-8-13)20-14(16(22)24-19-20)15(21)18-11-4-2-3-10(17)9-11/h2-9H,1H3,(H-,18,19,21,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3cccc(c3)Cl | |
| AKOS005250238 | 345.737 | C16 H12 Cl N3 O4 | ABMPFQITXQKDMK-UHFFFAOYSA-N | InChI=1S/C16H12ClN3O4/c1-23-13-8-6-12(7-9-13)20-14(16(22)24-19-20)15(21)18-11-4-2-10(17)3-5-11/h2-9H,1H3,(H-,18,19,21,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(cc3)Cl | |
| AKOS005251208 | 345.348 | C16 H12 F N3 O3 S | YEZLXANWMYXBEF-UHFFFAOYSA-N | InChI=1S/C16H12FN3O3S/c17-12-8-4-5-9-13(12)18-14(21)10-24-15-16(22)23-19-20(15)11-6-2-1-3-7-11/h1-9H,10H2,(H-,18,19,21,22) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccccc3F | |
| AKOS005251215 | 345.348 | C16 H12 F N3 O3 S | MUOOUEHXUBSIHA-UHFFFAOYSA-N | InChI=1S/C16H12FN3O3S/c17-11-6-8-12(9-7-11)18-14(21)10-24-15-16(22)23-19-20(15)13-4-2-1-3-5-13/h1-9H,10H2,(H-,18,19,21,22) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)F | |
| AKOS005250135 | 329.283 | C16 H12 F N3 O4 | AVEMMAXSADEFKM-UHFFFAOYSA-N | InChI=1S/C16H12FN3O4/c1-23-11-8-6-10(7-9-11)20-14(16(22)24-19-20)15(21)18-13-5-3-2-4-12(13)17/h2-9H,1H3,(H-,18,19,21,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccccc3F | |
| AKOS005250136 | 329.283 | C16 H12 F N3 O4 | CFTHCKPUOHNWHF-UHFFFAOYSA-N | InChI=1S/C16H12FN3O4/c1-23-13-8-6-12(7-9-13)20-14(16(22)24-19-20)15(21)18-11-4-2-10(17)3-5-11/h2-9H,1H3,(H-,18,19,21,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(cc3)F | |
| AKOS005251216 | 453.254 | C16 H12 I N3 O3 S | NUDPFFMSXPONFX-UHFFFAOYSA-N | InChI=1S/C16H12IN3O3S/c17-11-6-8-12(9-7-11)18-14(21)10-24-15-16(22)23-19-20(15)13-4-2-1-3-5-13/h1-9H,10H2,(H-,18,19,21,22) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)I | |
| AKOS005250137 | 437.189 | C16 H12 I N3 O4 | FHVHQGRADZRLND-UHFFFAOYSA-N | InChI=1S/C16H12IN3O4/c1-23-13-8-6-12(7-9-13)20-14(16(22)24-19-20)15(21)18-11-4-2-10(17)3-5-11/h2-9H,1H3,(H-,18,19,21,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(cc3)I | |
| AKOS005219522 | 312.343 | C16 H12 N2 O3 S | QUIQEPQWMMLCQS-UHFFFAOYSA-N | InChI=1S/C16H12N2O3S/c19-14(11-22-13-9-5-2-6-10-13)15-16(20)21-17-18(15)12-7-3-1-4-8-12/h1-10H,11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3ccccc3 | |
| AKOS005250106 | 368.37 | C16 H12 N6 O3 S | BUVCCKRUUSKVHO-UHFFFAOYSA-N | InChI=1S/C16H12N6O3S/c1-24-9-4-2-8(3-5-9)22-13(16(23)25-21-22)12-10(6-17)14(19)26-15(20)11(12)7-18/h2-5,12H,19-20H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C3C(=C(SC(=C3C#N)N)N)C#N | |
| AKOS005215534 | 316.739 | C16 H13 Cl N2 O3 | PCYXQHSFXVSELW-UHFFFAOYSA-N | InChI=1S/C16H13ClN2O3/c17-13-8-6-11(7-9-13)14(20)10-19-15(16(21)22-18-19)12-4-2-1-3-5-12/h1-9,14,20H,10H2 | c1ccc(cc1)c2c(on[n+]2CC(c3ccc(cc3)Cl)O)[O-] | MFCD09881654 |
| AKOS005215631 | 408.882 | C16 H13 Cl N4 O3 S2 | VVKFSQNSZRMPIA-UHFFFAOYSA-N | InChI=1S/C16H13ClN4O3S2/c1-9(2)21-15(26-16-18-12(17)11(8-22)25-16)14(24-20-21)19-13(23)10-6-4-3-5-7-10/h3-9H,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)Sc3nc(c(s3)C=O)Cl | |
| AKOS005250675 | 327.358 | C16 H13 N3 O3 S | YTTGDQRJPCZTMO-UHFFFAOYSA-N | InChI=1S/C16H13N3O3S/c17-11-5-4-8-13(9-11)23-10-14(20)15-16(21)22-18-19(15)12-6-2-1-3-7-12/h1-9H,10,17H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3cccc(c3)N | |
| AKOS005251132 | 327.358 | C16 H13 N3 O3 S | JVNOCJKMJIXVIG-UHFFFAOYSA-N | InChI=1S/C16H13N3O3S/c20-14(17-12-7-3-1-4-8-12)11-23-15-16(21)22-18-19(15)13-9-5-2-6-10-13/h1-10H,11H2,(H-,17,18,20,21) | c1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250292 | 311.292 | C16 H13 N3 O4 | FHCQXXRVXULFNC-UHFFFAOYSA-N | InChI=1S/C16H13N3O4/c1-22-13-9-7-12(8-10-13)19-14(16(21)23-18-19)15(20)17-11-5-3-2-4-6-11/h2-10H,1H3,(H-,17,18,20,21) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccccc3 | |
| AKOS005250536 | 311.292 | C16 H13 N3 O4 | ZNJIOLJKJUVKJK-UHFFFAOYSA-N | InChI=1S/C16H13N3O4/c1-19-14(16(21)23-18-19)15(20)17-11-7-9-13(10-8-11)22-12-5-3-2-4-6-12/h2-10H,1H3,(H-,17,18,20,21) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)Oc3ccccc3 | |
| AKOS005250452 | 343.357 | C16 H13 N3 O4 S | XIWYLFYPXMZQPU-UHFFFAOYSA-N | InChI=1S/C16H13N3O4S/c1-22-12-7-5-11(6-8-12)19-15(16(21)23-18-19)13(20)10-24-14-4-2-3-9-17-14/h2-9H,10H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3ccccn3 | |
| AKOS005215632 | 307.307 | C16 H13 N5 O2 | CQQIJJRRYXHHRL-UHFFFAOYSA-N | InChI=1S/C16H13N5O2/c1-11(2)21-14(8-12(9-17)10-18)16(23-20-21)19-15(22)13-6-4-3-5-7-13/h3-8,11H,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)C=C(C#N)C#N | |
| AKOS005214339 | 315.754 | C16 H14 Cl N3 O2 | VMBCFQISHMGWEY-UHFFFAOYSA-N | InChI=1S/C16H14ClN3O2/c17-14-9-5-4-6-12(14)10-18-11-15-16(21)22-19-20(15)13-7-2-1-3-8-13/h1-9,18H,10-11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3ccccc3Cl | |
| AKOS005214169 | 299.3 | C16 H14 F N3 O2 | FULANLMQZYTBLN-UHFFFAOYSA-N | InChI=1S/C16H14FN3O2/c17-13-8-6-12(7-9-13)10-18-11-15-16(21)22-19-20(15)14-4-2-1-3-5-14/h1-9,18H,10-11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3ccc(cc3)F | |
| AKOS005219475 | 365.31 | C16 H14 F3 N5 O2 | YXZVZBSMPBVGLY-UHFFFAOYSA-N | InChI=1S/C16H14F3N5O2/c1-8(2)24-12(13(26-23-24)22-14(25)16(17,18)19)11-9-3-4-10(5-9)15(11,6-20)7-21/h3-4,8-11H,5H2,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)C(F)(F)F)C2C3CC(C2(C#N)C#N)C=C3 | |
| AKOS005215729 | 282.294 | C16 H14 N2 O3 | XFMCBGGFBHMCPC-UHFFFAOYSA-N | InChI=1S/C16H14N2O3/c1-16(20,13-10-6-3-7-11-13)18-14(15(19)21-17-18)12-8-4-2-5-9-12/h2-11,20H,1H3 | CC(c1ccccc1)([n+]2c(c(on2)[O-])c3ccccc3)O | |
| AKOS005219495 | 346.358 | C16 H14 N2 O5 S | CYEUZPHNYQVDJP-UHFFFAOYSA-N | InChI=1S/C16H14N2O5S/c1-21-12-6-4-11(5-7-12)18-15(16(20)23-17-18)14(19)10-24-9-13-3-2-8-22-13/h2-8H,9-10H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSCc3ccco3 | |
| AKOS005250113 | 310.307 | C16 H14 N4 O3 | CLGOXTJHXGPJKN-UHFFFAOYSA-O | InChI=1S/C16H13N4O3/c1-22-14-9-7-13(8-10-14)20-15(16(21)23-19-20)11-17-18-12-5-3-2-4-6-12/h2-11H,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=N/Nc3ccccc3 | |
| AKOS005250788 | 342.372 | C16 H14 N4 O3 S | BRDVGQDJQUAOSW-UHFFFAOYSA-N | InChI=1S/C16H14N4O3S/c1-10-8-11(2)18-16(17-10)24-9-13(21)14-15(22)23-19-20(14)12-6-4-3-5-7-12/h3-8H,9H2,1-2H3 | Cc1cc(nc(n1)SCC(=O)c2c(on[n+]2c3ccccc3)[O-])C | |
| AKOS005250629 | 326.307 | C16 H14 N4 O4 | WNIIVFWWXOEARE-UHFFFAOYSA-N | InChI=1S/C16H14N4O4/c1-23-13-6-4-12(5-7-13)20-14(16(22)24-19-20)15(21)18-10-11-3-2-8-17-9-11/h2-9H,10H2,1H3,(H-,18,19,21,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCc3cccnc3 | |
| AKOS005251103 | 358.372 | C16 H14 N4 O4 S | YWDWYFRCWWHUED-UHFFFAOYSA-N | InChI=1S/C16H14N4O4S/c1-19-13(15(23)24-18-19)12(21)8-25-16-17-11-5-3-2-4-10(11)14(22)20(16)9-6-7-9/h2-5,9H,6-8H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2nc3ccccc3c(=O)n2C4CC4 | |
| AKOS005251201 | 406.436 | C16 H14 N4 O5 S2 | GQCQBTYPQIGABQ-UHFFFAOYSA-N | InChI=1S/C16H14N4O5S2/c17-27(23,24)13-8-6-11(7-9-13)18-14(21)10-26-15-16(22)25-19-20(15)12-4-2-1-3-5-12/h1-9H,10H2,(H3-,17,18,19,21,22,23,24) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)S(=O)(=O)N | |
| AKOS005250191 | 390.371 | C16 H14 N4 O6 S | STEPLHFIXXFDFL-UHFFFAOYSA-N | InChI=1S/C16H14N4O6S/c1-25-12-6-4-11(5-7-12)20-14(16(22)26-19-20)15(21)18-10-2-8-13(9-3-10)27(17,23)24/h2-9H,1H3,(H3-,17,18,19,21,22,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(cc3)S(=O)(=O)N | |
| AKOS005252778 | 394.899 | C16 H15 Cl N4 O2 S2 | RDHHGTXZMQYESH-UHFFFAOYSA-N | InChI=1S/C16H15ClN4O2S2/c1-10(2)21-7-15(23-20-21)19-14(22)9-25-16-18-13(8-24-16)11-3-5-12(17)6-4-11/h3-8,10H,9H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nc(cs2)c3ccc(cc3)Cl | |
| AKOS005253385 | 410.898 | C16 H15 Cl N4 O3 S2 | HXOFOYGIIYDFDB-UHFFFAOYSA-N | InChI=1S/C16H15ClN4O3S2/c1-23-7-6-21-8-15(24-20-21)19-14(22)10-26-16-18-13(9-25-16)11-2-4-12(17)5-3-11/h2-5,8-9H,6-7,10H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2nc(cs2)c3ccc(cc3)Cl | |
| AKOS005252961 | 428.389 | C16 H15 F3 N6 O3 S | JBJHQSQQBKIYMN-UHFFFAOYSA-N | InChI=1S/C16H15F3N6O3S/c1-10-6-12(16(17,18)19)11(7-20)15(21-10)29-9-13(26)22-14-8-25(23-28-14)24-2-4-27-5-3-24/h6,8H,2-5,9H2,1H3 | Cc1cc(c(c(n1)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3)C#N)C(F)(F)F | |
| AKOS005252962 | 428.389 | C16 H15 F3 N6 O3 S | UKKYXUBKMZNYKW-UHFFFAOYSA-N | InChI=1S/C16H15F3N6O3S/c1-10-6-12(16(17,18)19)21-15(11(10)7-20)29-9-13(26)22-14-8-25(23-28-14)24-2-4-27-5-3-24/h6,8H,2-5,9H2,1H3 | Cc1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3)C(F)(F)F | |
| AKOS005214210 | 281.309 | C16 H15 N3 O2 | CBWSTNMXRQWFDH-UHFFFAOYSA-N | InChI=1S/C16H15N3O2/c20-16-15(12-17-11-13-7-3-1-4-8-13)19(18-21-16)14-9-5-2-6-10-14/h1-10,17H,11-12H2 | c1ccc(cc1)CNCc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250357 | 297.309 | C16 H15 N3 O3 | ZEYSJJGJSZHOFB-UHFFFAOYSA-N | InChI=1S/C16H15N3O3/c1-18(10-14-16(21)22-17-19(14)2)15(20)13-8-7-11-5-3-4-6-12(11)9-13/h3-9H,10H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)c2ccc3ccccc3c2 | |
| AKOS005250674 | 329.374 | C16 H15 N3 O3 S | NNZVPXPMSZPRLV-UHFFFAOYSA-N | InChI=1S/C16H15N3O3S/c17-11-6-8-13(9-7-11)23-10-14(20)15-16(21)22-18-19(15)12-4-2-1-3-5-12/h1-6,8H,7,9-10,17H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=CC=C(CC3)N | |
| AKOS005251463 | 329.374 | C16 H15 N3 O3 S | FJSBXCMLCGSMMR-UHFFFAOYSA-N | InChI=1S/C16H15N3O3S/c1-10(23-15-16(21)22-18-19(15)2)14(20)17-13-8-7-11-5-3-4-6-12(11)9-13/h3-10H,1-2H3,(H-,17,18,20,21) | CC(C(=O)Nc1ccc2ccccc2c1)Sc3c(on[n+]3C)[O-] | |
| AKOS005251464 | 329.374 | C16 H15 N3 O3 S | FTKLYLJSCQNDNQ-UHFFFAOYSA-N | InChI=1S/C16H15N3O3S/c1-10(23-15-16(21)22-18-19(15)2)14(20)17-13-9-5-7-11-6-3-4-8-12(11)13/h3-10H,1-2H3,(H-,17,18,20,21) | CC(C(=O)Nc1cccc2c1cccc2)Sc3c(on[n+]3C)[O-] | |
| AKOS005252378 | 329.374 | C16 H15 N3 O3 S | SJRLKZYJAWKXKP-UHFFFAOYSA-N | InChI=1S/C16H15N3O3S/c1-19-15(16(21)22-18-19)23-9-8-14(20)17-13-7-6-11-4-2-3-5-12(11)10-13/h2-7,10H,8-9H2,1H3,(H-,17,18,20,21) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc3ccccc3c2 | |
| AKOS005252379 | 329.374 | C16 H15 N3 O3 S | MPJCNDIPJKQMIC-UHFFFAOYSA-N | InChI=1S/C16H15N3O3S/c1-19-15(16(21)22-18-19)23-10-9-14(20)17-13-8-4-6-11-5-2-3-7-12(11)13/h2-8H,9-10H2,1H3,(H-,17,18,20,21) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2cccc3c2cccc3 | |
| AKOS005250303 | 345.373 | C16 H15 N3 O4 S | UWEULEMIBPPMEG-UHFFFAOYSA-N | InChI=1S/C16H15N3O4S/c1-18(15(20)14-4-3-9-24-14)10-13-16(21)23-17-19(13)11-5-7-12(22-2)8-6-11/h3-9H,10H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)c3cccs3 | |
| AKOS005250343 | 345.373 | C16 H15 N3 O4 S | PSTBEYYAZJUQJL-UHFFFAOYSA-N | InChI=1S/C16H15N3O4S/c1-18(15(20)11-7-8-24-10-11)9-14-16(21)23-17-19(14)12-3-5-13(22-2)6-4-12/h3-8,10H,9H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)c3ccsc3 | |
| AKOS005250279 | 329.307 | C16 H15 N3 O5 | RXIUPGLCSAKRMC-UHFFFAOYSA-N | InChI=1S/C16H15N3O5/c1-18(15(20)14-4-3-9-23-14)10-13-16(21)24-17-19(13)11-5-7-12(22-2)8-6-11/h3-9H,10H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)c3ccco3 | |
| AKOS005215573 | 357.387 | C16 H15 N5 O3 S | DKRMHKQFJCTVAE-UHFFFAOYSA-N | InChI=1S/C16H15N5O3S/c1-11(2)21-15(8-13(9-17)10-18)16(24-20-21)19-25(22,23)14-6-4-12(3)5-7-14/h4-8,11H,1-3H3 | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)C=C(C#N)C#N | |
| AKOS005252468 | 357.387 | C16 H15 N5 O3 S | VZOXBSZBLJUANY-UHFFFAOYSA-N | InChI=1S/C16H15N5O3S/c1-20-8-14(24-19-20)18-13(22)9-25-16-17-12-5-3-2-4-11(12)15(23)21(16)10-6-7-10/h2-5,8,10H,6-7,9H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3c(=O)n2C4CC4 | |
| AKOS005252798 | 369.401 | C16 H15 N7 O2 S | IGICPABSPFQPCQ-UHFFFAOYSA-N | InChI=1S/C16H15N7O2S/c1-2-23-7-13(25-22-23)20-12(24)8-26-16-11(6-18)14(9-3-4-9)10(5-17)15(19)21-16/h7,9H,2-4,8H2,1H3,(H2-,19,20,21,22,24) | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)C3CC3)C#N | |
| AKOS005252884 | 369.401 | C16 H15 N7 O2 S | YCHPIAPRCHXBBD-UHFFFAOYSA-N | InChI=1S/C16H15N7O2S/c1-9(2)23-7-13(25-22-23)18-12(24)8-26-16-19-15-14(20-21-16)10-5-3-4-6-11(10)17-15/h3-7,9H,8H2,1-2H3,(H-,17,18,19,20,21,22,24) | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nc3c(c4ccccc4[nH]3)nn2 | |
| AKOS005253291 | 385.4 | C16 H15 N7 O3 S | RDJCHNALUYPSQA-UHFFFAOYSA-N | InChI=1S/C16H15N7O3S/c1-25-7-6-23-8-13(26-22-23)18-12(24)9-27-16-19-15-14(20-21-16)10-4-2-3-5-11(10)17-15/h2-5,8H,6-7,9H2,1H3,(H-,17,18,19,20,21,22,24) | COCC[n+]1cc(on1)[N-]C(=O)CSc2nc3c(c4ccccc4[nH]3)nn2 | |
| AKOS005253513 | 454.298 | C16 H16 Br N5 O4 S | XKEMDHKNOMLSDO-UHFFFAOYSA-N | InChI=1S/C16H16BrN5O4S/c1-20-14(24)11(7-13(23)18-10-5-3-9(17)4-6-10)22(16(20)27)8-12-15(25)26-19-21(12)2/h3-6,11H,7-8H2,1-2H3,(H-,18,19,23,25) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C)CC(=O)Nc3ccc(cc3)Br | |
| AKOS005253506 | 409.847 | C16 H16 Cl N5 O4 S | VHTNBMRJHJFZGF-UHFFFAOYSA-N | InChI=1S/C16H16ClN5O4S/c1-20-14(24)11(7-13(23)18-10-5-3-9(17)4-6-10)22(16(20)27)8-12-15(25)26-19-21(12)2/h3-6,11H,7-8H2,1-2H3,(H-,18,19,23,25) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C)CC(=O)Nc3ccc(cc3)Cl | |
| AKOS005253521 | 393.393 | C16 H16 F N5 O4 S | DYCZBFWTITZZTD-UHFFFAOYSA-N | InChI=1S/C16H16FN5O4S/c1-20-14(24)11(7-13(23)18-10-5-3-9(17)4-6-10)22(16(20)27)8-12-15(25)26-19-21(12)2/h3-6,11H,7-8H2,1-2H3,(H-,18,19,23,25) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C)CC(=O)Nc3ccc(cc3)F | |
| AKOS005253514 | 501.299 | C16 H16 I N5 O4 S | UWKIVXRZJCPFLA-UHFFFAOYSA-N | InChI=1S/C16H16IN5O4S/c1-20-14(24)11(7-13(23)18-10-5-3-9(17)4-6-10)22(16(20)27)8-12-15(25)26-19-21(12)2/h3-6,11H,7-8H2,1-2H3,(H-,18,19,23,25) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C)CC(=O)Nc3ccc(cc3)I | |
| AKOS005214736 | 296.324 | C16 H16 N4 O2 | UKAWNCCLPGOFCH-UHFFFAOYSA-N | InChI=1S/C16H16N4O2/c1-12-4-6-14(7-5-12)20-15(16(21)22-19-20)11-18-10-13-3-2-8-17-9-13/h2-9,18H,10-11H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3cccnc3 | |
| AKOS005252670 | 360.454 | C16 H16 N4 O2 S2 | QNZPNCBSLSOTIF-UHFFFAOYSA-N | InChI=1S/C16H16N4O2S2/c1-11(2)20-8-15(22-19-20)18-14(21)10-24-16-17-13(9-23-16)12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nc(cs2)c3ccccc3 | |
| AKOS005252824 | 360.454 | C16 H16 N4 O2 S2 | IQUODLLVQAVPQG-UHFFFAOYSA-N | InChI=1S/C16H16N4O2S2/c1-3-20-8-15(22-19-20)18-14(21)10-24-16-17-13(9-23-16)12-6-4-11(2)5-7-12/h4-9H,3,10H2,1-2H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2nc(cs2)c3ccc(cc3)C | |
| AKOS005214742 | 312.323 | C16 H16 N4 O3 | YLUHLALRDZMQCI-UHFFFAOYSA-N | InChI=1S/C16H16N4O3/c1-22-14-6-4-13(5-7-14)20-15(16(21)23-19-20)11-18-10-12-3-2-8-17-9-12/h2-9,18H,10-11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3cccnc3 | |
| AKOS005219538 | 344.388 | C16 H16 N4 O3 S | DWQCWKPIWSFHJS-UHFFFAOYSA-N | InChI=1S/C16H16N4O3S/c1-9-3-4-12-10(5-9)6-11(7-17)15(18-12)24-8-13(21)14-16(22)23-19-20(14)2/h6,9H,3-5,8H2,1-2H3 | CC1CCc2c(cc(c(n2)SCC(=O)c3c(on[n+]3C)[O-])C#N)C1 | |
| AKOS005250733 | 344.388 | C16 H16 N4 O3 S | JSORDEFJGFZYGH-UHFFFAOYSA-N | InChI=1S/C16H16N4O3S/c1-20-14(16(22)23-19-20)13(21)9-24-15-11(8-17)7-10-5-3-2-4-6-12(10)18-15/h7H,2-6,9H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2c(cc3c(n2)CCCCC3)C#N | |
| AKOS005251965 | 344.388 | C16 H16 N4 O3 S | MSGKLLMKRSSMHA-UHFFFAOYSA-N | InChI=1S/C16H16N4O3S/c1-3-13(24-15-16(22)23-19-20(15)2)14(21)18-12-8-4-7-11-10(12)6-5-9-17-11/h4-9,13H,3H2,1-2H3,(H-,17,18,19,21,22) | CCC(C(=O)Nc1cccc2c1cccn2)Sc3c(on[n+]3C)[O-] | |
| AKOS005253863 | 344.388 | C16 H16 N4 O3 S | IUNUZTLVXDPITP-UHFFFAOYSA-N | InChI=1S/C16H16N4O3S/c1-7-3-4-10-8(5-7)6-9-11(17)14(24-15(9)18-10)13(21)12-16(22)23-19-20(12)2/h6-7H,3-5H2,1-2H3,(H2-,17,19,21,22) | CC1CCc2c(cc3c(c(sc3n2)C(=O)c4c(on[n+]4C)[O-])N)C1 | |
| AKOS005253887 | 344.388 | C16 H16 N4 O3 S | AWDYDJQGVLVQAD-UHFFFAOYSA-N | InChI=1S/C16H16N4O3S/c1-20-12(16(22)23-19-20)13(21)14-11(17)9-7-8-5-3-2-4-6-10(8)18-15(9)24-14/h7H,2-6H2,1H3,(H2-,17,19,21,22) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3cc4c(nc3s2)CCCCC4)N | |
| AKOS005252826 | 376.453 | C16 H16 N4 O3 S2 | ZWCWPRWGIMQSAP-UHFFFAOYSA-N | InChI=1S/C16H16N4O3S2/c1-3-20-8-15(23-19-20)18-14(21)10-25-16-17-13(9-24-16)11-4-6-12(22-2)7-5-11/h4-9H,3,10H2,1-2H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2nc(cs2)c3ccc(cc3)OC | |
| AKOS005253377 | 376.453 | C16 H16 N4 O3 S2 | JKAJVIQDNWEWPE-UHFFFAOYSA-N | InChI=1S/C16H16N4O3S2/c1-22-8-7-20-9-15(23-19-20)18-14(21)11-25-16-17-13(10-24-16)12-5-3-2-4-6-12/h2-6,9-10H,7-8,11H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2nc(cs2)c3ccccc3 | |
| AKOS005250911 | 328.323 | C16 H16 N4 O4 | SWSGHXRJEDINKQ-UHFFFAOYSA-O | InChI=1S/C16H15N4O4/c1-20-13(16(23)24-19-20)9-12(15(22)17-11-7-8-11)18-14(21)10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H,17,22)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NC2CC2)\NC(=O)c3ccccc3 | |
| AKOS005250944 | 328.323 | C16 H16 N4 O4 | BKROMSXMJSWAQG-UHFFFAOYSA-O | InChI=1S/C16H15N4O4/c1-3-9-17-15(22)12(10-13-16(23)24-19-20(13)2)18-14(21)11-7-5-4-6-8-11/h3-8,10H,1,9H2,2H3,(H,17,22)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCC=C)\NC(=O)c2ccccc2 | |
| AKOS005253346 | 344.322 | C16 H16 N4 O5 | JVVBWNJEKRBGQB-UHFFFAOYSA-N | InChI=1S/C16H16N4O5/c1-9(21)10-3-5-11(6-4-10)20-14(22)7-12(15(20)23)17-8-13-16(24)25-18-19(13)2/h3-6,12,17H,7-8H2,1-2H3 | CC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)NCc3c(on[n+]3C)[O-] | |
| AKOS005253347 | 360.321 | C16 H16 N4 O6 | TVSJWBSQRNSQKC-UHFFFAOYSA-N | InChI=1S/C16H16N4O6/c1-19-12(16(24)26-18-19)8-17-11-7-13(21)20(14(11)22)10-5-3-9(4-6-10)15(23)25-2/h3-6,11,17H,7-8H2,1-2H3 | C[n+]1c(c(on1)[O-])CNC2CC(=O)N(C2=O)c3ccc(cc3)C(=O)OC | |
| AKOS005253473 | 420.4 | C16 H16 N6 O6 S | NERQEXNUYLTORO-UHFFFAOYSA-N | InChI=1S/C16H16N6O6S/c1-19-14(24)11(21(16(19)29)8-12-15(25)28-18-20(12)2)7-13(23)17-9-3-5-10(6-4-9)22(26)27/h3-6,11H,7-8H2,1-2H3,(H-,17,18,23,25) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C)CC(=O)Nc3ccc(cc3)N(=O)=O | |
| AKOS005252761 | 384.416 | C16 H16 N8 O2 S | LTSPBRHFNHXYJE-UHFFFAOYSA-N | InChI=1S/C16H16N8O2S/c1-23(2)24-7-13(26-22-24)20-12(25)8-27-16-11(6-18)14(9-3-4-9)10(5-17)15(19)21-16/h7,9H,3-4,8H2,1-2H3,(H2-,19,20,21,22,25) | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)C3CC3)C#N | |
| AKOS005219895 | 425.234 | C16 H17 Br N4 O5 | OCMWENBHSRJJFG-UHFFFAOYSA-N | InChI=1S/C16H17BrN4O5/c1-20-12(16(24)26-19-20)9-21-6-7-25-13(15(21)23)8-14(22)18-11-4-2-10(17)3-5-11/h2-5,13H,6-9H2,1H3,(H-,18,19,22,24) | C[n+]1c(c(on1)[O-])CN2CCOC(C2=O)CC(=O)Nc3ccc(cc3)Br | |
| AKOS005219846 | 380.783 | C16 H17 Cl N4 O5 | RSOABCMOJHMGTA-UHFFFAOYSA-N | InChI=1S/C16H17ClN4O5/c1-20-12(16(24)26-19-20)9-21-6-7-25-13(15(21)23)8-14(22)18-11-4-2-10(17)3-5-11/h2-5,13H,6-9H2,1H3,(H-,18,19,22,24) | C[n+]1c(c(on1)[O-])CN2CCOC(C2=O)CC(=O)Nc3ccc(cc3)Cl | |
| AKOS005253644 | 364.328 | C16 H17 F N4 O5 | KTTUSCBOUKMKEI-UHFFFAOYSA-N | InChI=1S/C16H17FN4O5/c1-20-12(16(24)26-19-20)9-21-6-7-25-13(15(21)23)8-14(22)18-11-4-2-10(17)3-5-11/h2-5,13H,6-9H2,1H3,(H-,18,19,22,24) | C[n+]1c(c(on1)[O-])CN2CCOC(C2=O)CC(=O)Nc3ccc(cc3)F | |
| AKOS005253643 | 472.234 | C16 H17 I N4 O5 | RTOQPHKDJKQIFC-UHFFFAOYSA-N | InChI=1S/C16H17IN4O5/c1-20-12(16(24)26-19-20)9-21-6-7-25-13(15(21)23)8-14(22)18-11-4-2-10(17)3-5-11/h2-5,13H,6-9H2,1H3,(H-,18,19,22,24) | C[n+]1c(c(on1)[O-])CN2CCOC(C2=O)CC(=O)Nc3ccc(cc3)I | |
| AKOS005250322 | 299.324 | C16 H17 N3 O3 | UYPKVDCZOKTPNW-UHFFFAOYSA-N | InChI=1S/C16H17N3O3/c20-15(11-6-7-11)18(12-8-9-12)10-14-16(21)22-17-19(14)13-4-2-1-3-5-13/h1-5,11-12H,6-10H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)C4CC4 | |
| AKOS005251342 | 363.454 | C16 H17 N3 O3 S2 | CGXOTMJJNNIABM-UHFFFAOYSA-N | InChI=1S/C16H17N3O3S2/c20-13(11-24-16(23)18-9-5-2-6-10-18)14-15(21)22-17-19(14)12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC(=S)N3CCCCC3 | |
| AKOS005219506 | 331.323 | C16 H17 N3 O5 | PIJNPYOQRWMMNZ-UHFFFAOYSA-N | InChI=1S/C16H17N3O5/c1-4-23-16(22)13(20)12-15(24-18-19(12)10(2)3)17-14(21)11-8-6-5-7-9-11/h5-10H,4H2,1-3H3 | CCOC(=O)C(=O)c1c(on[n+]1C(C)C)[N-]C(=O)c2ccccc2 | |
| AKOS005251344 | 395.453 | C16 H17 N3 O5 S2 | REEJGWOFGKGPSN-UHFFFAOYSA-N | InChI=1S/C16H17N3O5S2/c1-22-12-4-2-11(3-5-12)19-14(15(21)24-17-19)13(20)10-26-16(25)18-6-8-23-9-7-18/h2-5H,6-10H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC(=S)N3CCOCC3 | |
| AKOS005219504 | 311.338 | C16 H17 N5 O2 | MXQALILPKGMUIY-UHFFFAOYSA-N | InChI=1S/C16H17N5O2/c1-9(2)21-14(15(23-20-21)19-10(3)22)13-11-4-5-12(6-11)16(13,7-17)8-18/h4-5,9,11-13H,6H2,1-3H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)C)C2C3CC(C2(C#N)C#N)C=C3 | |
| AKOS005252490 | 343.403 | C16 H17 N5 O2 S | YILOJLOBDGSMKG-UHFFFAOYSA-N | InChI=1S/C16H17N5O2S/c1-2-21-9-15(23-20-21)19-14(22)10-24-16-12(8-17)7-11-5-3-4-6-13(11)18-16/h7,9H,2-6,10H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCCC3)C#N | |
| AKOS005252525 | 343.403 | C16 H17 N5 O2 S | VQUQRQQTVBGQGX-UHFFFAOYSA-N | InChI=1S/C16H17N5O2S/c1-21-9-15(23-20-21)19-14(22)10-24-16-12(8-17)7-11-5-3-2-4-6-13(11)18-16/h7,9H,2-6,10H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCCCC3)C#N | |
| AKOS005252531 | 343.403 | C16 H17 N5 O2 S | YXXXXUOHCNHGNT-UHFFFAOYSA-N | InChI=1S/C16H17N5O2S/c1-10-3-4-13-11(5-10)6-12(7-17)16(18-13)24-9-14(22)19-15-8-21(2)20-23-15/h6,8,10H,3-5,9H2,1-2H3 | CC1CCc2c(cc(c(n2)SCC(=O)[N-]c3c[n+](no3)C)C#N)C1 | |
| AKOS005252834 | 343.403 | C16 H17 N5 O2 S | BEUABVDPVFEYNG-UHFFFAOYSA-N | InChI=1S/C16H17N5O2S/c1-10(2)21-8-15(23-20-21)19-14(22)9-24-16-12(7-17)6-11-4-3-5-13(11)18-16/h6,8,10H,3-5,9H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCC3)C#N | |
| AKOS005253146 | 375.468 | C16 H17 N5 O2 S2 | SQSQLZXWQHGLID-UHFFFAOYSA-N | InChI=1S/C16H17N5O2S2/c1-11-4-6-12(7-5-11)13-9-24-16(17-13)25-10-14(22)18-15-8-21(19-23-15)20(2)3/h4-9H,10H2,1-3H3 | Cc1ccc(cc1)c2csc(n2)SCC(=O)[N-]c3c[n+](no3)N(C)C | |
| AKOS005252455 | 359.403 | C16 H17 N5 O3 S | DYWGUTLEYPYTNC-UHFFFAOYSA-N | InChI=1S/C16H17N5O3S/c1-3-20-9-14(24-19-20)18-13(22)10-25-16-17-12-8-6-5-7-11(12)15(23)21(16)4-2/h5-9H,3-4,10H2,1-2H3 | CCn1c(=O)c2ccccc2nc1SCC(=O)[N-]c3c[n+](no3)CC | |
| AKOS005252875 | 359.403 | C16 H17 N5 O3 S | QWMYBWMKZVSDIP-UHFFFAOYSA-N | InChI=1S/C16H17N5O3S/c1-10(2)21-8-14(24-19-21)18-13(22)9-25-16-17-12-7-5-4-6-11(12)15(23)20(16)3/h4-8,10H,9H2,1-3H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3c(=O)n2C | |
| AKOS005253163 | 359.403 | C16 H17 N5 O3 S | ARPPUWWWHULNPG-UHFFFAOYSA-N | InChI=1S/C16H17N5O3S/c22-14(11-25-16-17-12-6-2-3-7-13(12)23-16)18-15-10-21(19-24-15)20-8-4-1-5-9-20/h2-3,6-7,10H,1,4-5,8-9,11H2 | c1ccc2c(c1)nc(o2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4 | |
| AKOS005253414 | 359.403 | C16 H17 N5 O3 S | PHHNXFANILPSTH-UHFFFAOYSA-N | InChI=1S/C16H17N5O3S/c1-23-6-5-21-9-15(24-20-21)19-14(22)10-25-16-12(8-17)7-11-3-2-4-13(11)18-16/h7,9H,2-6,10H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCC3)C#N | |
| AKOS005253155 | 391.468 | C16 H17 N5 O3 S2 | JEZFTCDQVCLPSK-UHFFFAOYSA-N | InChI=1S/C16H17N5O3S2/c1-20(2)21-8-15(24-19-21)18-14(22)10-26-16-17-13(9-25-16)11-4-6-12(23-3)7-5-11/h4-9H,10H2,1-3H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2nc(cs2)c3ccc(cc3)OC | |
| AKOS005252481 | 375.402 | C16 H17 N5 O4 S | OJWVSATXOXQOLF-UHFFFAOYSA-N | InChI=1S/C16H17N5O4S/c1-4-21-8-14(25-20-21)19-13(22)9-26-15-12(7-17)11(6-10(3)18-15)16(23)24-5-2/h6,8H,4-5,9H2,1-3H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)C)C(=O)OCC)C#N | |
| AKOS005253412 | 375.402 | C16 H17 N5 O4 S | HBFKEOLCWALXTB-UHFFFAOYSA-N | InChI=1S/C16H17N5O4S/c1-20-15(23)11-5-3-4-6-12(11)17-16(20)26-10-13(22)18-14-9-21(19-25-14)7-8-24-2/h3-6,9H,7-8,10H2,1-2H3 | Cn1c(=O)c2ccccc2nc1SCC(=O)[N-]c3c[n+](no3)CCOC | |
| AKOS005253450 | 375.402 | C16 H17 N5 O4 S | FGRCBJGORNUQCA-UHFFFAOYSA-N | InChI=1S/C16H17N5O4S/c1-19-14(23)11(8-13(22)17-10-6-4-3-5-7-10)21(16(19)26)9-12-15(24)25-18-20(12)2/h3-7,11H,8-9H2,1-2H3,(H-,17,18,22,24) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C)CC(=O)Nc3ccccc3 | |
| AKOS005251745 | 407.467 | C16 H17 N5 O4 S2 | HFVAIWUEKWOLQX-UHFFFAOYSA-N | InChI=1S/C16H17N5O4S2/c1-8(26-15-16(24)25-19-20(15)3)13(23)18-14-11(6-17)10-4-5-21(9(2)22)7-12(10)27-14/h8H,4-5,7H2,1-3H3,(H-,18,19,23,24) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)C)C#N)Sc3c(on[n+]3C)[O-] | |
| AKOS005252662 | 407.467 | C16 H17 N5 O4 S2 | LNENPOVTAWUFDQ-UHFFFAOYSA-N | InChI=1S/C16H17N5O4S2/c1-9(22)21-5-3-10-11(7-17)14(27-12(10)8-21)18-13(23)4-6-26-15-16(24)25-19-20(15)2/h3-6,8H2,1-2H3,(H-,18,19,23,24) | CC(=O)N1CCc2c(sc(c2C#N)NC(=O)CCSc3c(on[n+]3C)[O-])C1 | |
| AKOS005251288 | 359.337 | C16 H17 N5 O5 | WFROOKWOSQUOMU-UHFFFAOYSA-N | InChI=1S/C16H17N5O5/c1-19(8-12-16(25)26-18-20(12)2)11-7-13(22)21(15(11)24)10-5-3-9(4-6-10)14(17)23/h3-6,11H,7-8H2,1-2H3,(H2-,17,18,23,25) | C[n+]1c(c(on1)[O-])CN(C)C2CC(=O)N(C2=O)c3ccc(cc3)C(=O)N | |
| AKOS005253370 | 359.337 | C16 H17 N5 O5 | DBKLBVLUFUDXBZ-UHFFFAOYSA-N | InChI=1S/C16H17N5O5/c1-9(22)18-10-3-5-11(6-4-10)21-14(23)7-12(15(21)24)17-8-13-16(25)26-19-20(13)2/h3-6,12,17H,7-8H2,1-2H3,(H-,18,19,22,25) | CC(=O)Nc1ccc(cc1)N2C(=O)CC(C2=O)NCc3c(on[n+]3C)[O-] | |
| AKOS005253597 | 391.335 | C16 H17 N5 O7 | GMBCYCCCWRAUIS-UHFFFAOYSA-N | InChI=1S/C16H17N5O7/c1-19-12(16(24)28-18-19)9-20-6-7-27-13(15(20)23)8-14(22)17-10-2-4-11(5-3-10)21(25)26/h2-5,13H,6-9H2,1H3,(H-,17,18,22,24) | C[n+]1c(c(on1)[O-])CN2CCOC(C2=O)CC(=O)Nc3ccc(cc3)N(=O)=O | |
| AKOS005252916 | 371.417 | C16 H17 N7 O2 S | VUOIVEPXOFIHBQ-UHFFFAOYSA-N | InChI=1S/C16H17N7O2S/c1-4-23-7-13(25-22-23)20-12(24)8-26-16-11(6-18)14(9(2)3)10(5-17)15(19)21-16/h7,9H,4,8H2,1-3H3,(H2-,19,20,21,22,24) | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)C(C)C)C#N | |
| AKOS005250789 | 318.391 | C16 H18 N2 O3 S | ILQUJQJHADGNEX-UHFFFAOYSA-N | InChI=1S/C16H18N2O3S/c19-14(11-22-13-9-5-2-6-10-13)15-16(20)21-17-18(15)12-7-3-1-4-8-12/h1,3-4,7-8,13H,2,5-6,9-11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3CCCCC3 | |
| AKOS005251833 | 378.469 | C16 H18 N4 O3 S2 | PTZMYCBOAQRMPV-UHFFFAOYSA-N | InChI=1S/C16H18N4O3S2/c1-8-4-5-10-11(7-17)14(25-12(10)6-8)18-13(21)9(2)24-15-16(22)23-19-20(15)3/h8-9H,4-6H2,1-3H3,(H-,18,19,21,22) | CC1CCc2c(sc(c2C#N)NC(=O)C(C)Sc3c(on[n+]3C)[O-])C1 | |
| AKOS005251937 | 378.469 | C16 H18 N4 O3 S2 | WBZABLWTYAHASN-UHFFFAOYSA-N | InChI=1S/C16H18N4O3S2/c1-3-11(25-15-16(22)23-19-20(15)2)13(21)18-14-10(8-17)9-6-4-5-7-12(9)24-14/h11H,3-7H2,1-2H3,(H-,18,19,21,22) | CCC(C(=O)Nc1c(c2c(s1)CCCC2)C#N)Sc3c(on[n+]3C)[O-] | |
| AKOS005252658 | 378.469 | C16 H18 N4 O3 S2 | HVRUYYCHPVXKLM-UHFFFAOYSA-N | InChI=1S/C16H18N4O3S2/c1-9-3-4-10-11(8-17)14(25-12(10)7-9)18-13(21)5-6-24-15-16(22)23-19-20(15)2/h9H,3-7H2,1-2H3,(H-,18,19,21,22) | CC1CCc2c(sc(c2C#N)NC(=O)CCSc3c(on[n+]3C)[O-])C1 | |
| AKOS005251263 | 330.339 | C16 H18 N4 O4 | RNXALPJKBGVEIM-UHFFFAOYSA-N | InChI=1S/C16H18N4O4/c1-10-4-6-11(7-5-10)20-14(21)8-12(15(20)22)18(2)9-13-16(23)24-17-19(13)3/h4-7,12H,8-9H2,1-3H3 | Cc1ccc(cc1)N2C(=O)CC(C2=O)N(C)Cc3c(on[n+]3C)[O-] | |
| AKOS005215337 | 362.404 | C16 H18 N4 O4 S | FHKQKGGNZJBMAE-UHFFFAOYSA-N | InChI=1S/C16H18N4O4S/c1-9(2)20-12(15-17-11(8-25-15)16(22)23)14(24-19-20)18-13(21)10-6-4-3-5-7-10/h3-7,9,11,15,17H,8H2,1-2H3,(H-,18,19,21,22,23) | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)C3NC(CS3)C(=O)O | |
| AKOS005250091 | 346.338 | C16 H18 N4 O5 | YLUYROZOTWLOME-UHFFFAOYSA-N | InChI=1S/C16H18N4O5/c1-19-12(16(23)25-18-19)10-20-7-8-24-13(15(20)22)9-14(21)17-11-5-3-2-4-6-11/h2-6,13H,7-10H2,1H3,(H-,17,18,21,23) | C[n+]1c(c(on1)[O-])CN2CCOC(C2=O)CC(=O)Nc3ccccc3 | |
| AKOS005250556 | 346.338 | C16 H18 N4 O5 | VBETXQXPUDGVSQ-UHFFFAOYSA-N | InChI=1S/C16H18N4O5/c1-24-12-4-2-11(3-5-12)20-13(16(23)25-18-20)15(22)19-8-6-10(7-9-19)14(17)21/h2-5,10H,6-9H2,1H3,(H2-,17,18,21,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCC(CC3)C(=O)N | |
| AKOS005250566 | 346.338 | C16 H18 N4 O5 | VJQZYKJMHGTQNC-UHFFFAOYSA-N | InChI=1S/C16H18N4O5/c1-2-24-16(23)19-10-8-18(9-11-19)14(21)13-15(22)25-17-20(13)12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3 | CCOC(=O)N1CCN(CC1)C(=O)c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250592 | 346.338 | C16 H18 N4 O5 | RVRVTFMQMNSWLO-UHFFFAOYSA-N | InChI=1S/C16H18N4O5/c1-24-12-6-4-11(5-7-12)20-13(16(23)25-18-20)15(22)19-8-2-3-10(9-19)14(17)21/h4-7,10H,2-3,8-9H2,1H3,(H2-,17,18,21,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCCC(C3)C(=O)N | |
| AKOS005250609 | 346.338 | C16 H18 N4 O5 | GXCMRHSZMYABFG-UHFFFAOYSA-N | InChI=1S/C16H18N4O5/c1-11(21)18-7-9-19(10-8-18)15(22)14-16(23)25-17-20(14)12-3-5-13(24-2)6-4-12/h3-6H,7-10H2,1-2H3 | CC(=O)N1CCN(CC1)C(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251279 | 346.338 | C16 H18 N4 O5 | IDUVIPACZNBMIF-UHFFFAOYSA-N | InChI=1S/C16H18N4O5/c1-18(9-13-16(23)25-17-19(13)2)12-8-14(21)20(15(12)22)10-4-6-11(24-3)7-5-10/h4-7,12H,8-9H2,1-3H3 | C[n+]1c(c(on1)[O-])CN(C)C2CC(=O)N(C2=O)c3ccc(cc3)OC | |
| AKOS005253354 | 346.338 | C16 H18 N4 O5 | KGGLZYFJALZCPW-UHFFFAOYSA-N | InChI=1S/C16H18N4O5/c1-3-24-11-6-4-10(5-7-11)20-14(21)8-12(15(20)22)17-9-13-16(23)25-18-19(13)2/h4-7,12,17H,3,8-9H2,1-2H3 | CCOc1ccc(cc1)N2C(=O)CC(C2=O)NCc3c(on[n+]3C)[O-] | |
| AKOS005250608 | 394.402 | C16 H18 N4 O6 S | DMRLGZKFCMUWQU-UHFFFAOYSA-N | InChI=1S/C16H18N4O6S/c1-4-25-15(23)11-9-5-6-20(8(2)21)7-10(9)27-14(11)17-13(22)12-16(24)26-18-19(12)3/h4-7H2,1-3H3,(H-,17,18,22,23,24) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3C)[O-])CN(CC2)C(=O)C | |
| AKOS005251571 | 426.467 | C16 H18 N4 O6 S2 | BHXFWIAXOJEERJ-UHFFFAOYSA-N | InChI=1S/C16H18N4O6S2/c1-8(21)20-5-4-9-10(6-20)28-13(12(9)15(23)25-3)17-11(22)7-27-14-16(24)26-18-19(14)2/h4-7H2,1-3H3,(H-,17,18,22,23,24) | CC(=O)N1CCc2c(sc(c2C(=O)OC)NC(=O)CSc3c(on[n+]3C)[O-])C1 | |
| AKOS005253339 | 411.929 | C16 H18 N5 O2 S2 . Cl | YAPISHIDEFREOW-UHFFFAOYSA-N | InChI=1S/C16H17N5O2S2.ClH/c1-2-21-8-14(23-20-21)19-13(22)9-24-16-11-6-4-3-5-10(11)12(7-17)15(18)25-16;/h8,18H,2-6,9H2,1H3;1H | CC[n+]1cc(on1)[N-]C(=O)CSc2c3c(c(c([s+]2)N)C#N)CCCC3.[Cl-] | |
| AKOS005252697 | 358.418 | C16 H18 N6 O2 S | BPYNDJUUNYVGRK-UHFFFAOYSA-N | InChI=1S/C16H18N6O2S/c1-21(2)22-9-15(24-20-22)19-14(23)10-25-16-12(8-17)7-11-5-3-4-6-13(11)18-16/h7,9H,3-6,10H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCCC3)C#N | |
| AKOS005253046 | 358.418 | C16 H18 N6 O2 S | HLXQHMYUMIEQAW-UHFFFAOYSA-N | InChI=1S/C16H18N6O2S/c23-14(11-25-16-17-12-6-2-3-7-13(12)18-16)19-15-10-22(20-24-15)21-8-4-1-5-9-21/h2-3,6-7,10H,1,4-5,8-9,11H2,(H-,17,18,19,20,23) | c1ccc2c(c1)[nH]c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4 | |
| AKOS005253056 | 358.418 | C16 H18 N6 O2 S | XPKRFCDWGUXGNI-UHFFFAOYSA-N | InChI=1S/C16H18N6O2S/c1-12-5-6-13(9-17)16(18-12)25-11-14(23)19-15-10-22(20-24-15)21-7-3-2-4-8-21/h5-6,10H,2-4,7-8,11H2,1H3 | Cc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3)C#N | |
| AKOS005252687 | 374.418 | C16 H18 N6 O3 S | WNUMVVMOOXXRKU-UHFFFAOYSA-N | InChI=1S/C16H18N6O3S/c1-4-21-15(24)11-7-5-6-8-12(11)17-16(21)26-10-13(23)18-14-9-22(19-25-14)20(2)3/h5-9H,4,10H2,1-3H3 | CCn1c(=O)c2ccccc2nc1SCC(=O)[N-]c3c[n+](no3)N(C)C | |
| AKOS005252943 | 374.418 | C16 H18 N6 O3 S | QBIINQSQDFCZKA-UHFFFAOYSA-N | InChI=1S/C16H18N6O3S/c1-11-7-12(2)18-16(13(11)8-17)26-10-14(23)19-15-9-22(20-25-15)21-3-5-24-6-4-21/h7,9H,3-6,10H2,1-2H3 | Cc1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3)C | |
| AKOS005252693 | 390.417 | C16 H18 N6 O4 S | QMKLVVVQNXMXDS-UHFFFAOYSA-N | InChI=1S/C16H18N6O4S/c1-5-25-16(24)11-6-10(2)18-15(12(11)7-17)27-9-13(23)19-14-8-22(20-26-14)21(3)4/h6,8H,5,9H2,1-4H3 | CCOC(=O)c1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)N(C)C)C | |
| AKOS005253522 | 454.481 | C16 H18 N6 O6 S2 | VJBJWMDZIUXENE-UHFFFAOYSA-N | InChI=1S/C16H18N6O6S2/c1-20-14(24)11(22(16(20)29)8-12-15(25)28-19-21(12)2)7-13(23)18-9-3-5-10(6-4-9)30(17,26)27/h3-6,11H,7-8H2,1-2H3,(H3-,17,18,19,23,25,26,27) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C)CC(=O)Nc3ccc(cc3)S(=O)(=O)N | |
| AKOS005252738 | 386.432 | C16 H18 N8 O2 S | SCCANADSKJOLOL-UHFFFAOYSA-N | InChI=1S/C16H18N8O2S/c1-9(2)14-10(5-17)15(19)21-16(11(14)6-18)27-8-12(25)20-13-7-24(22-26-13)23(3)4/h7,9H,8H2,1-4H3,(H2-,19,20,21,22,25) | CC(C)c1c(c(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)N(C)C)N)C#N | |
| AKOS005253049 | 386.432 | C16 H18 N8 O2 S | BFAOKUMKEJAQRV-UHFFFAOYSA-N | InChI=1S/C16H18N8O2S/c25-14(17-15-11-23(21-26-15)22-9-5-2-6-10-22)12-27-16-18-19-20-24(16)13-7-3-1-4-8-13/h1,3-4,7-8,11H,2,5-6,9-10,12H2 | c1ccc(cc1)n2c(nnn2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4 | |
| AKOS005215621 | 317.406 | C16 H19 N3 O2 S | PELLNEJVLGKOGK-UHFFFAOYSA-N | InChI=1S/C16H19N3O2S/c1-11(2)19-16(22-10-12-8-9-12)15(21-18-19)17-14(20)13-6-4-3-5-7-13/h3-7,11-12H,8-10H2,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)SCC3CC3 | |
| AKOS005219490 | 301.34 | C16 H19 N3 O3 | QWAFMUCYXXSLMF-UHFFFAOYSA-N | InChI=1S/C16H19N3O3/c1-2-6-15(20)18(12-9-10-12)11-14-16(21)22-17-19(14)13-7-4-3-5-8-13/h3-5,7-8,12H,2,6,9-11H2,1H3 | CCCC(=O)N(Cc1c(on[n+]1c2ccccc2)[O-])C3CC3 | |
| AKOS005250142 | 317.34 | C16 H19 N3 O4 | BRHBSCHXGXDXDW-UHFFFAOYSA-N | InChI=1S/C16H19N3O4/c1-22-13-9-7-12(8-10-13)19-14(16(21)23-18-19)15(20)17-11-5-3-2-4-6-11/h7-11H,2-6H2,1H3,(H-,17,18,20,21) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NC3CCCCC3 | |
| AKOS005250342 | 317.34 | C16 H19 N3 O4 | UKJYUUDOKPVDMS-UHFFFAOYSA-N | InChI=1S/C16H19N3O4/c1-18(15(20)11-4-3-5-11)10-14-16(21)23-17-19(14)12-6-8-13(22-2)9-7-12/h6-9,11H,3-5,10H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)C3CCC3 | |
| AKOS005250594 | 317.34 | C16 H19 N3 O4 | KTEPWKXOJBCJMN-UHFFFAOYSA-N | InChI=1S/C16H19N3O4/c1-11-5-3-4-10-18(11)15(20)14-16(21)23-17-19(14)12-6-8-13(22-2)9-7-12/h6-9,11H,3-5,10H2,1-2H3 | CC1CCCCN1C(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250619 | 317.34 | C16 H19 N3 O4 | PQHDJPSTOGJFHC-UHFFFAOYSA-N | InChI=1S/C16H19N3O4/c1-11-4-3-9-18(10-11)15(20)14-16(21)23-17-19(14)12-5-7-13(22-2)8-6-12/h5-8,11H,3-4,9-10H2,1-2H3 | CC1CCCN(C1)C(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250620 | 317.34 | C16 H19 N3 O4 | HHGMYEMVDSUEJQ-UHFFFAOYSA-N | InChI=1S/C16H19N3O4/c1-11-7-9-18(10-8-11)15(20)14-16(21)23-17-19(14)12-3-5-13(22-2)6-4-12/h3-6,11H,7-10H2,1-2H3 | CC1CCN(CC1)C(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005214936 | 333.339 | C16 H19 N3 O5 | XOQJCIDRBOJHDY-UHFFFAOYSA-N | InChI=1S/C16H19N3O5/c1-10(20)15-16(17-11(2)21)24-18-19(15)8-7-12-5-6-13(22-3)14(9-12)23-4/h5-6,9H,7-8H2,1-4H3 | CC(=O)c1c(on[n+]1CCc2ccc(c(c2)OC)OC)[N-]C(=O)C | |
| AKOS005250593 | 333.339 | C16 H19 N3 O5 | HGPKITHUJDMTOC-UHFFFAOYSA-N | InChI=1S/C16H19N3O5/c1-10-8-18(9-11(2)23-10)15(20)14-16(21)24-17-19(14)12-4-6-13(22-3)7-5-12/h4-7,10-11H,8-9H2,1-3H3 | CC1CN(CC(O1)C)C(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250551 | 365.404 | C16 H19 N3 O5 S | HSMSMSPZJGXRMT-UHFFFAOYSA-N | InChI=1S/C16H19N3O5S/c1-19-12(16(22)24-18-19)13(20)17-14-11(15(21)23-2)9-7-5-3-4-6-8-10(9)25-14/h3-8H2,1-2H3,(H-,17,18,20,21,22) | C[n+]1c(c(on1)[O-])C(=O)Nc2c(c3c(s2)CCCCCC3)C(=O)OC | |
| AKOS005250571 | 365.404 | C16 H19 N3 O5 S | ZNTPHRGODQCIAM-UHFFFAOYSA-N | InChI=1S/C16H19N3O5S/c1-4-23-15(21)11-9-6-5-8(2)7-10(9)25-14(11)17-13(20)12-16(22)24-18-19(12)3/h8H,4-7H2,1-3H3,(H-,17,18,20,21,22) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3C)[O-])CC(CC2)C | |
| AKOS005250622 | 365.404 | C16 H19 N3 O5 S | XTZFUFVFHXCRMJ-UHFFFAOYSA-N | InChI=1S/C16H19N3O5S/c1-3-23-15(21)11-9-7-5-4-6-8-10(9)25-14(11)17-13(20)12-16(22)24-18-19(12)2/h3-8H2,1-2H3,(H-,17,18,20,21,22) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3C)[O-])CCCCC2 | |
| AKOS005251123 | 365.404 | C16 H19 N3 O5 S | QTGMQEVBYHEARA-UHFFFAOYSA-N | InChI=1S/C16H19N3O5S/c1-3-4-9-23-15(21)11-5-7-12(8-6-11)17-13(20)10-25-14-16(22)24-18-19(14)2/h5-8H,3-4,9-10H2,1-2H3,(H-,17,18,20,21,22) | CCCCOC(=O)c1ccc(cc1)NC(=O)CSc2c(on[n+]2C)[O-] | |
| AKOS005252059 | 365.404 | C16 H19 N3 O5 S | ILEXZJZJRBPGFP-UHFFFAOYSA-N | InChI=1S/C16H19N3O5S/c1-4-12(25-14-16(22)24-18-19(14)3)13(20)17-11-8-6-10(7-9-11)15(21)23-5-2/h6-9,12H,4-5H2,1-3H3,(H-,17,18,20,21,22) | CCC(C(=O)Nc1ccc(cc1)C(=O)OCC)Sc2c(on[n+]2C)[O-] | |
| AKOS005251576 | 397.469 | C16 H19 N3 O5 S2 | SKWCGPPPVRRCLY-UHFFFAOYSA-N | InChI=1S/C16H19N3O5S2/c1-19-14(16(22)24-18-19)25-8-11(20)17-13-12(15(21)23-2)9-6-4-3-5-7-10(9)26-13/h3-8H2,1-2H3,(H-,17,18,20,21,22) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2c(c3c(s2)CCCCC3)C(=O)OC | |
| AKOS005251600 | 397.469 | C16 H19 N3 O5 S2 | BSFMWAXDRORIJL-UHFFFAOYSA-N | InChI=1S/C16H19N3O5S2/c1-8-4-5-9-10(6-8)26-13(12(9)15(21)23-3)17-11(20)7-25-14-16(22)24-18-19(14)2/h8H,4-7H2,1-3H3,(H-,17,18,20,21,22) | CC1CCc2c(sc(c2C(=O)OC)NC(=O)CSc3c(on[n+]3C)[O-])C1 | |
| AKOS005251625 | 397.469 | C16 H19 N3 O5 S2 | MBTQJKYOLJJCEO-UHFFFAOYSA-N | InChI=1S/C16H19N3O5S2/c1-3-23-15(21)12-9-6-4-5-7-10(9)26-13(12)17-11(20)8-25-14-16(22)24-18-19(14)2/h3-8H2,1-2H3,(H-,17,18,20,21,22) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3C)[O-])CCCC2 | |
| AKOS005251656 | 397.469 | C16 H19 N3 O5 S2 | MMPCTUIHPONJNU-UHFFFAOYSA-N | InChI=1S/C16H19N3O5S2/c1-8(25-14-16(22)24-18-19(14)2)12(20)17-13-11(15(21)23-3)9-6-4-5-7-10(9)26-13/h8H,4-7H2,1-3H3,(H-,17,18,20,21,22) | CC(C(=O)Nc1c(c2c(s1)CCCC2)C(=O)OC)Sc3c(on[n+]3C)[O-] | |
| AKOS005252654 | 397.469 | C16 H19 N3 O5 S2 | IJPNZBSLDLZFMA-UHFFFAOYSA-N | InChI=1S/C16H19N3O5S2/c1-19-14(16(22)24-18-19)25-8-7-11(20)17-13-12(15(21)23-2)9-5-3-4-6-10(9)26-13/h3-8H2,1-2H3,(H-,17,18,20,21,22) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2c(c3c(s2)CCCC3)C(=O)OC | |
| AKOS005219461 | 345.419 | C16 H19 N5 O2 S | ARRZLCCMZRNFAE-UHFFFAOYSA-N | InChI=1S/C16H19N5O2S/c1-8(2)11-6-5-10-13(17)14(24-16(10)18-11)15(22)19-12-7-21(9(3)4)20-23-12/h5-9H,1-4H3,(H2-,17,19,20,22) | CC(C)c1ccc2c(c(sc2n1)C(=O)[N-]c3c[n+](no3)C(C)C)N | |
| AKOS005219558 | 345.419 | C16 H19 N5 O2 S | LNOOIXBFSWVZHN-UHFFFAOYSA-N | InChI=1S/C16H19N5O2S/c1-10(2)13-6-5-12(7-17)16(18-13)24-9-14(22)19-15-8-21(11(3)4)20-23-15/h5-6,8,10-11H,9H2,1-4H3 | CC(C)c1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)C(C)C)C#N | |
| AKOS005252474 | 345.419 | C16 H19 N5 O2 S | BKYWORRQJFWERO-UHFFFAOYSA-N | InChI=1S/C16H19N5O2S/c1-4-21-9-15(23-20-21)19-14(22)10-24-16-12(8-17)5-6-13(18-16)7-11(2)3/h5-6,9,11H,4,7,10H2,1-3H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)CC(C)C)C#N | |
| AKOS005252501 | 345.419 | C16 H19 N5 O2 S | UHDOSBGLQWIMRL-UHFFFAOYSA-N | InChI=1S/C16H19N5O2S/c1-3-5-6-13-8-7-12(9-17)16(18-13)24-11-14(22)19-15-10-21(4-2)20-23-15/h7-8,10H,3-6,11H2,1-2H3 | CCCCc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)CC)C#N | |
| AKOS005252837 | 345.419 | C16 H19 N5 O2 S | OJYMVJDNKNGWGJ-UHFFFAOYSA-N | InChI=1S/C16H19N5O2S/c1-4-5-13-7-6-12(8-17)16(18-13)24-10-14(22)19-15-9-21(11(2)3)20-23-15/h6-7,9,11H,4-5,10H2,1-3H3 | CCCc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)C(C)C)C#N | |
| AKOS005252861 | 345.419 | C16 H19 N5 O2 S | BAMSLTAVBTZNFE-UHFFFAOYSA-N | InChI=1S/C16H19N5O2S/c1-9(2)21-7-15(23-20-21)19-14(22)8-24-16-13(6-17)11(4)10(3)12(5)18-16/h7,9H,8H2,1-5H3 | Cc1c(c(c(nc1C)SCC(=O)[N-]c2c[n+](no2)C(C)C)C#N)C | |
| AKOS005253302 | 361.419 | C16 H19 N5 O3 S | OTAKETDVGSJPGT-UHFFFAOYSA-N | InChI=1S/C16H19N5O3S/c1-11(2)13-5-4-12(8-17)16(18-13)25-10-14(22)19-15-9-21(20-24-15)6-7-23-3/h4-5,9,11H,6-7,10H2,1-3H3 | CC(C)c1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)CCOC)C#N | |
| AKOS005253304 | 361.419 | C16 H19 N5 O3 S | DWEQQXITPOCIKM-UHFFFAOYSA-N | InChI=1S/C16H19N5O3S/c1-3-4-13-6-5-12(9-17)16(18-13)25-11-14(22)19-15-10-21(20-24-15)7-8-23-2/h5-6,10H,3-4,7-8,11H2,1-2H3 | CCCc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)CCOC)C#N | |
| AKOS005253408 | 361.419 | C16 H19 N5 O3 S | MHWHOSFMIIUWSR-UHFFFAOYSA-N | InChI=1S/C16H19N5O3S/c1-10-11(2)13(7-17)16(18-12(10)3)25-9-14(22)19-15-8-21(20-24-15)5-6-23-4/h8H,5-6,9H2,1-4H3 | Cc1c(c(c(nc1C)SCC(=O)[N-]c2c[n+](no2)CCOC)C#N)C | |
| AKOS005253581 | 425.416 | C16 H19 N5 O7 S | WJEYCVPWWQLIEM-UHFFFAOYSA-N | InChI=1S/C16H19N5O7S/c1-20-12(16(24)28-19-20)9-21-6-7-27-13(15(21)23)8-14(22)18-10-2-4-11(5-3-10)29(17,25)26/h2-5,13H,6-9H2,1H3,(H3-,17,18,19,22,24,25,26) | C[n+]1c(c(on1)[O-])CN2CCOC(C2=O)CC(=O)Nc3ccc(cc3)S(=O)(=O)N | |
| AKOS005253362 | 426.944 | C16 H19 N6 O2 S2 . Cl | LSFNKNUPXWWRLK-UHFFFAOYSA-N | InChI=1S/C16H18N6O2S2.ClH/c1-21(2)22-8-14(24-20-22)19-13(23)9-25-16-11-6-4-3-5-10(11)12(7-17)15(18)26-16;/h8,18H,3-6,9H2,1-2H3;1H | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c3c(c(c([s+]2)N)C#N)CCCC3.[Cl-] | |
| AKOS005214242 | 300.356 | C16 H20 N4 O2 | BNZRPEFAOGDPGB-UHFFFAOYSA-N | InChI=1S/C16H20N4O2/c1-11(2)20-15(16(21)22-19-20)10-17-8-7-12-9-18-14-6-4-3-5-13(12)14/h3-6,9,11,17-18H,7-8,10H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCCc2c[nH]c3c2cccc3 | |
| AKOS005215582 | 300.356 | C16 H20 N4 O2 | IHQVZQNFDYISDJ-UHFFFAOYSA-N | InChI=1S/C16H20N4O2/c1-11(2)20-14(10-17-13-8-9-13)16(22-19-20)18-15(21)12-6-4-3-5-7-12/h3-7,11,13,17H,8-10H2,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CNC3CC3 | |
| AKOS005253051 | 332.421 | C16 H20 N4 O2 S | ADKDYOXLEFSKHV-UHFFFAOYSA-N | InChI=1S/C16H20N4O2S/c21-15(13-23-12-14-7-3-1-4-8-14)17-16-11-20(18-22-16)19-9-5-2-6-10-19/h1,3-4,7-8,11H,2,5-6,9-10,12-13H2 | c1ccc(cc1)CSCC(=O)[N-]c2c[n+](no2)N3CCCCC3 | |
| AKOS005253141 | 332.421 | C16 H20 N4 O2 S | DUTGSFVLDRXXCB-UHFFFAOYSA-N | InChI=1S/C16H20N4O2S/c1-13-5-7-14(8-6-13)23-12-15(21)17-16-11-20(18-22-16)19-9-3-2-4-10-19/h5-8,11H,2-4,9-10,12H2,1H3 | Cc1ccc(cc1)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3 | |
| AKOS005250563 | 332.354 | C16 H20 N4 O4 | WZOMFRQWRNYSDU-UHFFFAOYSA-N | InChI=1S/C16H20N4O4/c1-3-18-8-10-19(11-9-18)15(21)14-16(22)24-17-20(14)12-4-6-13(23-2)7-5-12/h4-7H,3,8-11H2,1-2H3 | CCN1CCN(CC1)C(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250612 | 332.354 | C16 H20 N4 O4 | UHJDFHYPCHJMEH-UHFFFAOYSA-N | InChI=1S/C16H20N4O4/c1-18-8-3-9-19(11-10-18)15(21)14-16(22)24-17-20(14)12-4-6-13(23-2)7-5-12/h4-7H,3,8-11H2,1-2H3 | CN1CCCN(CC1)C(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250601 | 348.354 | C16 H20 N4 O5 | DAEDJUXVVZVXKQ-UHFFFAOYSA-N | InChI=1S/C16H20N4O5/c1-24-13-4-2-12(3-5-13)20-14(16(23)25-17-20)15(22)19-8-6-18(7-9-19)10-11-21/h2-5,21H,6-11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)CCO | |
| AKOS005250630 | 348.354 | C16 H20 N4 O5 | QYVZORPNSWQXAQ-UHFFFAOYSA-N | InChI=1S/C16H20N4O5/c1-23-13-4-2-12(3-5-13)20-14(16(22)25-18-20)15(21)17-6-7-19-8-10-24-11-9-19/h2-5H,6-11H2,1H3,(H-,17,18,21,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCCN3CCOCC3 | |
| AKOS005219793 | 364.353 | C16 H20 N4 O6 | BUGHAHGYWMJUCL-UHFFFAOYSA-N | InChI=1S/C16H20N4O6/c1-18(8-13-16(24)26-17-19(13)2)14(21)9-20(10-15(22)23)11-4-6-12(25-3)7-5-11/h4-7H,8-10H2,1-3H3,(H-,17,22,23,24) | C[n+]1c(c(on1)[O-])CN(C)C(=O)CN(CC(=O)O)c2ccc(cc2)OC | |
| AKOS005219826 | 364.353 | C16 H20 N4 O6 | IWDHKCSJNSFMIY-UHFFFAOYSA-N | InChI=1S/C16H20N4O6/c1-18(8-13-16(24)26-17-19(13)2)14(21)9-20(10-15(22)23)11-5-4-6-12(7-11)25-3/h4-7H,8-10H2,1-3H3,(H-,17,22,23,24) | C[n+]1c(c(on1)[O-])CN(C)C(=O)CN(CC(=O)O)c2cccc(c2)OC | |
| AKOS005252699 | 360.434 | C16 H20 N6 O2 S | ITDUNXPEALRGHR-UHFFFAOYSA-N | InChI=1S/C16H20N6O2S/c1-4-5-6-13-8-7-12(9-17)16(18-13)25-11-14(23)19-15-10-22(20-24-15)21(2)3/h7-8,10H,4-6,11H2,1-3H3 | CCCCc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)N(C)C)C#N | |
| AKOS005252768 | 360.434 | C16 H20 N6 O2 S | NGSLPDPCJZVNAU-UHFFFAOYSA-N | InChI=1S/C16H20N6O2S/c1-11(2)7-13-6-5-12(8-17)16(18-13)25-10-14(23)19-15-9-22(20-24-15)21(3)4/h5-6,9,11H,7,10H2,1-4H3 | CC(C)Cc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)N(C)C)C#N | |
| AKOS005214337 | 287.357 | C16 H21 N3 O2 | RMCXNSYALLPISF-UHFFFAOYSA-N | InChI=1S/C16H21N3O2/c20-16-15(12-17-13-8-4-1-2-5-9-13)19(18-21-16)14-10-6-3-7-11-14/h3,6-7,10-11,13,17H,1-2,4-5,8-9,12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CCCCCC3 | |
| AKOS005214826 | 287.357 | C16 H21 N3 O2 | KEAVFSOMHAINHP-UHFFFAOYSA-N | InChI=1S/C16H21N3O2/c1-12-7-9-14(10-8-12)19-15(16(20)21-18-19)11-17-13-5-3-2-4-6-13/h7-10,13,17H,2-6,11H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CCCCC3 | |
| AKOS005214823 | 303.356 | C16 H21 N3 O3 | SLQPIJLODQEZGK-UHFFFAOYSA-N | InChI=1S/C16H21N3O3/c1-21-14-9-7-13(8-10-14)19-15(16(20)22-18-19)11-17-12-5-3-2-4-6-12/h7-10,12,17H,2-6,11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CCCCC3 | |
| AKOS005250259 | 303.356 | C16 H21 N3 O3 | GQZAQNPKGJOPHR-UHFFFAOYSA-N | InChI=1S/C16H21N3O3/c1-16(2,3)10-14(20)18(4)11-13-15(21)22-17-19(13)12-8-6-5-7-9-12/h5-9H,10-11H2,1-4H3 | CC(C)(C)CC(=O)N(C)Cc1c(on[n+]1c2ccccc2)[O-] | |
| AKOS005252044 | 335.421 | C16 H21 N3 O3 S | ZBQWSSDHGMCOIN-UHFFFAOYSA-N | InChI=1S/C16H21N3O3S/c1-5-13(23-15-16(21)22-18-19(15)4)14(20)17-12-8-6-11(7-9-12)10(2)3/h6-10,13H,5H2,1-4H3,(H-,17,18,20,21) | CCC(C(=O)Nc1ccc(cc1)C(C)C)Sc2c(on[n+]2C)[O-] | |
| AKOS005252063 | 335.421 | C16 H21 N3 O3 S | CAZRNOFWEQQCGW-UHFFFAOYSA-N | InChI=1S/C16H21N3O3S/c1-5-11-9-7-8-10(3)13(11)17-14(20)12(6-2)23-15-16(21)22-18-19(15)4/h7-9,12H,5-6H2,1-4H3,(H-,17,18,20,21) | CCc1cccc(c1NC(=O)C(CC)Sc2c(on[n+]2C)[O-])C | |
| AKOS005215629 | 319.356 | C16 H21 N3 O4 | MSUBKHYMPTZADF-UHFFFAOYSA-N | InChI=1S/C16H21N3O4/c1-16(2,3)22-15(20)17-14-11-19(18-23-14)10-9-12-7-5-6-8-13(12)21-4/h5-8,11H,9-10H2,1-4H3 | CC(C)(C)OC(=O)[N-]c1c[n+](no1)CCc2ccccc2OC | |
| AKOS005250272 | 319.356 | C16 H21 N3 O4 | USNFKKPAMVGIGU-UHFFFAOYSA-N | InChI=1S/C16H21N3O4/c1-4-5-6-15(20)18(2)11-14-16(21)23-17-19(14)12-7-9-13(22-3)10-8-12/h7-10H,4-6,11H2,1-3H3 | CCCCC(=O)N(C)Cc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005251427 | 351.421 | C16 H21 N3 O4 S | AEUJBDWQJWIXPU-UHFFFAOYSA-N | InChI=1S/C16H21N3O4S/c1-4-5-10-22-13-8-6-12(7-9-13)17-14(20)11(2)24-15-16(21)23-18-19(15)3/h6-9,11H,4-5,10H2,1-3H3,(H-,17,18,20,21) | CCCCOc1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2C)[O-] | |
| AKOS005252352 | 351.421 | C16 H21 N3 O4 S | MBFSNLVDYGJDHX-UHFFFAOYSA-N | InChI=1S/C16H21N3O4S/c1-3-4-10-22-13-7-5-12(6-8-13)17-14(20)9-11-24-15-16(21)23-18-19(15)2/h5-8H,3-4,9-11H2,1-2H3,(H-,17,18,20,21) | CCCCOc1ccc(cc1)NC(=O)CCSc2c(on[n+]2C)[O-] | |
| AKOS005215075 | 335.355 | C16 H21 N3 O5 | UBSZKNXAKMZWAT-UHFFFAOYSA-N | InChI=1S/C16H21N3O5/c1-10(20)15-16(17-11(2)21)24-18-19(15)8-7-12-5-6-13(22-3)14(9-12)23-4/h5-6,9-10,20H,7-8H2,1-4H3 | CC(c1c(on[n+]1CCc2ccc(c(c2)OC)OC)[N-]C(=O)C)O | |
| AKOS005214312 | 302.371 | C16 H22 N4 O2 | GXAYMNNXYNDVKG-UHFFFAOYSA-N | InChI=1S/C16H22N4O2/c1-19-15(16(21)22-18-19)11-17-14-7-9-20(10-8-14)12-13-5-3-2-4-6-13/h2-6,14,17H,7-12H2,1H3 | C[n+]1c(c(on1)[O-])CNC2CCN(CC2)Cc3ccccc3 | |
| AKOS005214744 | 318.371 | C16 H22 N4 O3 | UQRNOXOJHQOODD-UHFFFAOYSA-N | InChI=1S/C16H22N4O3/c1-13-2-4-14(5-3-13)20-15(16(21)23-18-20)12-17-6-7-19-8-10-22-11-9-19/h2-5,17H,6-12H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCN3CCOCC3 | |
| AKOS005219455 | 318.371 | C16 H22 N4 O3 | ZXANVZRYPKFARS-UHFFFAOYSA-N | InChI=1S/C16H22N4O3/c1-12(2)20-14(11-17-9-10-22-3)16(23-19-20)18-15(21)13-7-5-4-6-8-13/h4-8,12,17H,9-11H2,1-3H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CNCCOC | |
| AKOS005215439 | 354.832 | C16 H22 N4 O3 . Cl H | SMEOFQXFXBQRCW-UHFFFAOYSA-N | InChI=1S/C16H22N4O3.ClH/c1-12(2)20-14(11-17-9-10-22-3)16(23-19-20)18-15(21)13-7-5-4-6-8-13;/h4-8,12,17H,9-11H2,1-3H3;1H | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CNCCOC.Cl | |
| AKOS005214743 | 334.37 | C16 H22 N4 O4 | OLMAMYHSAHUOOX-UHFFFAOYSA-N | InChI=1S/C16H22N4O4/c1-22-14-4-2-13(3-5-14)20-15(16(21)24-18-20)12-17-6-7-19-8-10-23-11-9-19/h2-5,17H,6-12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCN3CCOCC3 | |
| AKOS005214986 | 334.37 | C16 H22 N4 O4 | ZCOUQCCEDJGIDD-UHFFFAOYSA-N | InChI=1S/C16H22N4O4/c1-11(21)18-16-13(10-17-2)20(19-24-16)8-7-12-5-6-14(22-3)15(9-12)23-4/h5-6,9,17H,7-8,10H2,1-4H3 | CC(=O)[N-]c1c([n+](no1)CCc2ccc(c(c2)OC)OC)CNC | |
| AKOS005214194 | 321.372 | C16 H23 N3 O4 | LYVDKQKJLJUEEK-UHFFFAOYSA-N | InChI=1S/C16H23N3O4/c1-11(2)19-13(16(20)23-18-19)10-17-8-7-12-5-6-14(21-3)15(9-12)22-4/h5-6,9,11,17H,7-8,10H2,1-4H3 | CC(C)[n+]1c(c(on1)[O-])CNCCc2ccc(c(c2)OC)OC | |
| AKOS005219542 | 426.393 | C16 H9 F3 N4 O3 S2 | IDCMJUFHGOVQIV-UHFFFAOYSA-N | InChI=1S/C16H9F3N4O3S2/c1-23-13(15(25)26-22-23)11(24)7-28-14-8(6-20)9(16(17,18)19)5-10(21-14)12-3-2-4-27-12/h2-5H,7H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2c(c(cc(n2)c3cccs3)C(F)(F)F)C#N | |
| AKOS005253878 | 426.393 | C16 H9 F3 N4 O3 S2 | HGEACTPPSLWJPH-UHFFFAOYSA-N | InChI=1S/C16H9F3N4O3S2/c1-23-11(15(25)26-22-23)12(24)13-10(20)9-6(16(17,18)19)5-7(21-14(9)28-13)8-3-2-4-27-8/h2-5H,1H3,(H2-,20,22,24,25) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4cccs4)C(F)(F)F)N | |
| AKOS005251202 | 399.32 | C16 H9 F4 N3 O3 S | KTDJWHPWZILPRN-UHFFFAOYSA-N | InChI=1S/C16H9F4N3O3S/c17-9-6-10(18)13(20)14(12(9)19)21-11(24)7-27-15-16(25)26-22-23(15)8-4-2-1-3-5-8/h1-6H,7H2,(H-,21,22,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3c(c(cc(c3F)F)F)F | |
| AKOS005250192 | 383.254 | C16 H9 F4 N3 O4 | OFNYYBHFCAXORR-UHFFFAOYSA-N | InChI=1S/C16H9F4N3O4/c1-26-8-4-2-7(3-5-8)23-14(16(25)27-22-23)15(24)21-13-11(19)9(17)6-10(18)12(13)20/h2-6H,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3c(c(cc(c3F)F)F)F | |
| AKOS005215688 | 307.26 | C16 H9 N3 O4 | MLQYNOLSAMOYOZ-UHFFFAOYSA-N | InChI=1S/C16H9N3O4/c20-16-15(18(17-23-16)13-4-2-1-3-5-13)11-8-12-6-9-14(10-7-12)19(21)22/h1-7,9-10H | c1ccc(cc1)[n+]2c(c(on2)[O-])C#Cc3ccc(cc3)N(=O)=O | |
| AKOS005253906 | 421.257 | C17 H10 Cl2 N4 O3 S | KBYGVZATBVBHKV-UHFFFAOYSA-N | InChI=1S/C17H10Cl2N4O3S/c1-23-13(17(25)26-22-23)14(24)15-12(20)9-4-5-11(21-16(9)27-15)8-3-2-7(18)6-10(8)19/h2-6H,1H3,(H2-,20,22,24,25) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3ccc(nc3s2)c4ccc(cc4Cl)Cl)N | |
| AKOS005250396 | 393.34 | C17 H10 F3 N3 O3 S | UTAWXJJWYSTZOF-UHFFFAOYSA-N | InChI=1S/C17H10F3N3O3S/c1-22-14(16(25)26-21-22)15(24)23-10-4-2-3-5-12(10)27-13-7-6-9(8-11(13)23)17(18,19)20/h2-8H,1H3 | C[n+]1c(c(on1)[O-])C(=O)N2c3ccccc3Sc4c2cc(cc4)C(F)(F)F | |
| AKOS005251143 | 429.801 | C17 H11 Cl F3 N3 O3 S | UOCIUUUPDRBNNN-UHFFFAOYSA-N | InChI=1S/C17H11ClF3N3O3S/c18-10-6-7-13(12(8-10)17(19,20)21)22-14(25)9-28-15-16(26)27-23-24(15)11-4-2-1-3-5-11/h1-8H,9H2,(H-,22,23,25,26) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3C(F)(F)F)Cl | |
| AKOS005251144 | 429.801 | C17 H11 Cl F3 N3 O3 S | XAERYWLVWFFVPY-UHFFFAOYSA-N | InChI=1S/C17H11ClF3N3O3S/c18-12-7-6-10(17(19,20)21)8-13(12)22-14(25)9-28-15-16(26)27-23-24(15)11-4-2-1-3-5-11/h1-8H,9H2,(H-,22,23,25,26) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cc(ccc3Cl)C(F)(F)F | |
| AKOS005250226 | 413.735 | C17 H11 Cl F3 N3 O4 | QWBCHSSWILQYPW-UHFFFAOYSA-N | InChI=1S/C17H11ClF3N3O4/c1-27-11-5-3-10(4-6-11)24-14(16(26)28-23-24)15(25)22-13-7-2-9(18)8-12(13)17(19,20)21/h2-8H,1H3,(H-,22,23,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(cc3C(F)(F)F)Cl | |
| AKOS005250227 | 413.735 | C17 H11 Cl F3 N3 O4 | ZNUVARSZDAEORO-UHFFFAOYSA-N | InChI=1S/C17H11ClF3N3O4/c1-27-11-5-3-10(4-6-11)24-14(16(26)28-23-24)15(25)22-13-8-9(17(19,20)21)2-7-12(13)18/h2-8H,1H3,(H-,22,23,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3cc(ccc3Cl)C(F)(F)F | |
| AKOS005250748 | 386.812 | C17 H11 Cl N4 O3 S | VOEWFLUEYMQYNI-UHFFFAOYSA-N | InChI=1S/C17H11ClN4O3S/c1-22-15(17(24)25-21-22)14(23)9-26-16-11(8-19)4-7-13(20-16)10-2-5-12(18)6-3-10/h2-7H,9H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2c(ccc(n2)c3ccc(cc3)Cl)C#N | |
| AKOS005253865 | 386.812 | C17 H11 Cl N4 O3 S | PQLVCECJFVIEEP-UHFFFAOYSA-N | InChI=1S/C17H11ClN4O3S/c1-22-13(17(24)25-21-22)14(23)15-12(19)10-6-7-11(20-16(10)26-15)8-2-4-9(18)5-3-8/h2-7H,1H3,(H2-,19,21,23,24) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3ccc(nc3s2)c4ccc(cc4)Cl)N | |
| AKOS005253892 | 370.358 | C17 H11 F N4 O3 S | JYKALCFNAPGGDW-UHFFFAOYSA-N | InChI=1S/C17H11FN4O3S/c1-22-13(17(24)25-21-22)14(23)15-12(19)10-6-7-11(20-16(10)26-15)8-2-4-9(18)5-3-8/h2-7H,1H3,(H2-,19,21,23,24) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3ccc(nc3s2)c4ccc(cc4)F)N | |
| AKOS005219746 | 392.289 | C17 H11 F3 N4 O4 | DFQUMVYHCBUVPS-UHFFFAOYSA-N | InChI=1S/C17H11F3N4O4/c1-24-12(16(26)28-23-24)10-9(7-21)15(22)27-14(17(18,19)20)11(10)13(25)8-5-3-2-4-6-8/h2-6,10H,22H2,1H3 | C[n+]1c(c(on1)[O-])C2C(=C(OC(=C2C(=O)c3ccccc3)C(F)(F)F)N)C#N | |
| AKOS005251768 | 413.346 | C17 H11 F4 N3 O3 S | KKMHGOWHQNQXIH-UHFFFAOYSA-N | InChI=1S/C17H11F4N3O3S/c1-8(15(25)22-14-12(20)10(18)7-11(19)13(14)21)28-16-17(26)27-23-24(16)9-5-3-2-4-6-9/h2-8H,1H3,(H-,22,23,25,26) | CC(C(=O)Nc1c(c(cc(c1F)F)F)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252153 | 413.346 | C17 H11 F4 N3 O3 S | SMNHBMWUIQPACO-UHFFFAOYSA-N | InChI=1S/C17H11F4N3O3S/c18-10-8-11(19)14(21)15(13(10)20)22-12(25)6-7-28-16-17(26)27-23-24(16)9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H-,22,23,25,26) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3c(c(cc(c3F)F)F)F | |
| AKOS005251559 | 429.346 | C17 H11 F4 N3 O4 S | CHFSXVPGALSPJR-UHFFFAOYSA-N | InChI=1S/C17H11F4N3O4S/c1-27-9-4-2-8(3-5-9)24-16(17(26)28-23-24)29-7-12(25)22-15-13(20)10(18)6-11(19)14(15)21/h2-6H,7H2,1H3,(H-,22,23,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3c(c(cc(c3F)F)F)F | |
| AKOS005219515 | 353.352 | C17 H11 N3 O4 S | AGPQKMJJBJPVHI-UHFFFAOYSA-N | InChI=1S/C17H11N3O4S/c21-13(10-25-17-18-12-8-4-5-9-14(12)23-17)15-16(22)24-19-20(15)11-6-2-1-3-7-11/h1-9H,10H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nc4ccccc4o3 | |
| AKOS005251170 | 405.812 | C17 H12 Cl N3 O5 S | JUFRRGLZAVYHMA-UHFFFAOYSA-N | InChI=1S/C17H12ClN3O5S/c18-13-7-6-10(8-12(13)16(23)24)19-14(22)9-27-15-17(25)26-20-21(15)11-4-2-1-3-5-11/h1-8H,9H2,(H2-,19,20,22,23,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(c(c3)C(=O)O)Cl | |
| AKOS005251177 | 405.812 | C17 H12 Cl N3 O5 S | SEFYLMLTADDTSQ-UHFFFAOYSA-N | InChI=1S/C17H12ClN3O5S/c18-12-7-6-10(16(23)24)8-13(12)19-14(22)9-27-15-17(25)26-20-21(15)11-4-2-1-3-5-11/h1-8H,9H2,(H2-,19,20,22,23,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cc(ccc3Cl)C(=O)O | |
| AKOS005250161 | 389.747 | C17 H12 Cl N3 O6 | NLTVLSOBULUSES-UHFFFAOYSA-N | InChI=1S/C17H12ClN3O6/c1-26-11-5-3-10(4-6-11)21-14(17(25)27-20-21)15(22)19-9-2-7-13(18)12(8-9)16(23)24/h2-8H,1H3,(H2-,19,20,22,23,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(c(c3)C(=O)O)Cl | |
| AKOS005250167 | 389.747 | C17 H12 Cl N3 O6 | GQMGSULFLFMWMW-UHFFFAOYSA-N | InChI=1S/C17H12ClN3O6/c1-26-11-5-3-10(4-6-11)21-14(17(25)27-20-21)15(22)19-13-8-9(16(23)24)2-7-12(13)18/h2-8H,1H3,(H2-,19,20,22,23,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3cc(ccc3Cl)C(=O)O | |
| AKOS005219551 | 385.827 | C17 H12 Cl N5 O2 S | LXJCMENPHBAMMU-UHFFFAOYSA-N | InChI=1S/C17H12ClN5O2S/c1-23-9-16(25-22-23)21-15(24)10-26-17-12(8-19)4-7-14(20-17)11-2-5-13(18)6-3-11/h2-7,9H,10H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)c3ccc(cc3)Cl)C#N | |
| AKOS005251133 | 395.356 | C17 H12 F3 N3 O3 S | RADBETCABTYWRF-UHFFFAOYSA-N | InChI=1S/C17H12F3N3O3S/c18-17(19,20)12-8-4-5-9-13(12)21-14(24)10-27-15-16(25)26-22-23(15)11-6-2-1-3-7-11/h1-9H,10H2,(H-,21,22,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccccc3C(F)(F)F | |
| AKOS005251134 | 395.356 | C17 H12 F3 N3 O3 S | RKHLGIAUOLRRNQ-UHFFFAOYSA-N | InChI=1S/C17H12F3N3O3S/c18-17(19,20)11-5-4-6-12(9-11)21-14(24)10-27-15-16(25)26-22-23(15)13-7-2-1-3-8-13/h1-9H,10H2,(H-,21,22,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cccc(c3)C(F)(F)F | |
| AKOS005250220 | 379.29 | C17 H12 F3 N3 O4 | WSYYXAIUJCREHZ-UHFFFAOYSA-N | InChI=1S/C17H12F3N3O4/c1-26-13-7-5-12(6-8-13)23-14(16(25)27-22-23)15(24)21-11-4-2-3-10(9-11)17(18,19)20/h2-9H,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3cccc(c3)C(F)(F)F | |
| AKOS005250293 | 379.29 | C17 H12 F3 N3 O4 | BQYASSIXBSWJOJ-UHFFFAOYSA-N | InChI=1S/C17H12F3N3O4/c1-26-11-8-6-10(7-9-11)23-14(16(25)27-22-23)15(24)21-13-5-3-2-4-12(13)17(18,19)20/h2-9H,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccccc3C(F)(F)F | |
| AKOS005251147 | 411.355 | C17 H12 F3 N3 O4 S | FCFCGDUKDIUIKD-UHFFFAOYSA-N | InChI=1S/C17H12F3N3O4S/c18-17(19,20)26-13-9-5-4-8-12(13)21-14(24)10-28-15-16(25)27-22-23(15)11-6-2-1-3-7-11/h1-9H,10H2,(H-,21,22,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccccc3OC(F)(F)F | |
| AKOS005251212 | 411.355 | C17 H12 F3 N3 O4 S | SZCWUTNWACHSGB-UHFFFAOYSA-N | InChI=1S/C17H12F3N3O4S/c18-17(19,20)26-13-8-6-11(7-9-13)21-14(24)10-28-15-16(25)27-22-23(15)12-4-2-1-3-5-12/h1-9H,10H2,(H-,21,22,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)OC(F)(F)F | |
| AKOS005250154 | 395.289 | C17 H12 F3 N3 O5 | VMZRXTZGQGIJME-UHFFFAOYSA-N | InChI=1S/C17H12F3N3O5/c1-26-12-8-4-11(5-9-12)23-14(16(25)28-22-23)15(24)21-10-2-6-13(7-3-10)27-17(18,19)20/h2-9H,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(cc3)OC(F)(F)F | |
| AKOS005250162 | 395.289 | C17 H12 F3 N3 O5 | TYWQMRIVCLXOCE-UHFFFAOYSA-N | InChI=1S/C17H12F3N3O5/c1-26-11-8-6-10(7-9-11)23-14(16(25)28-22-23)15(24)21-12-4-2-3-5-13(12)27-17(18,19)20/h2-9H,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccccc3OC(F)(F)F | |
| AKOS005252508 | 439.435 | C17 H12 F3 N5 O2 S2 | RPNPBMBRXSKFAJ-UHFFFAOYSA-N | InChI=1S/C17H12F3N5O2S2/c1-2-25-8-15(27-24-25)23-14(26)9-29-16-10(7-21)11(17(18,19)20)6-12(22-16)13-4-3-5-28-13/h3-6,8H,2,9H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3cccs3)C(F)(F)F)C#N | |
| AKOS005219541 | 352.367 | C17 H12 N4 O3 S | ONYDDJOLVYZJMC-UHFFFAOYSA-N | InChI=1S/C17H12N4O3S/c1-21-15(17(23)24-20-21)14(22)10-25-16-12(9-18)7-8-13(19-16)11-5-3-2-4-6-11/h2-8H,10H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2c(ccc(n2)c3ccccc3)C#N | |
| AKOS005250787 | 352.367 | C17 H12 N4 O3 S | QGZALRKJDUZDIP-UHFFFAOYSA-N | InChI=1S/C17H12N4O3S/c22-14(10-25-17-18-12-8-4-5-9-13(12)19-17)15-16(23)24-20-21(15)11-6-2-1-3-7-11/h1-9H,10H2,(H-,18,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3[nH]c4ccccc4n3 | |
| AKOS005250847 | 352.367 | C17 H12 N4 O3 S | PJOFUCLWLCVJLO-UHFFFAOYSA-N | InChI=1S/C17H12N4O3S/c1-11-7-8-12(9-18)16(19-11)25-10-14(22)15-17(23)24-20-21(15)13-5-3-2-4-6-13/h2-8H,10H2,1H3 | Cc1ccc(c(n1)SCC(=O)c2c(on[n+]2c3ccccc3)[O-])C#N | |
| AKOS005253798 | 352.367 | C17 H12 N4 O3 S | BLQSUPRHPGSAOW-UHFFFAOYSA-N | InChI=1S/C17H12N4O3S/c1-9-7-8-11-12(18)15(25-16(11)19-9)14(22)13-17(23)24-20-21(13)10-5-3-2-4-6-10/h2-8H,1H3,(H2-,18,20,22,23) | Cc1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccccc4)[O-])N | |
| AKOS005253872 | 352.367 | C17 H12 N4 O3 S | LVWVYIZQCWUHKP-UHFFFAOYSA-N | InChI=1S/C17H12N4O3S/c1-21-13(17(23)24-20-21)14(22)15-12(18)10-7-8-11(19-16(10)25-15)9-5-3-2-4-6-9/h2-8H,1H3,(H2-,18,20,22,23) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3ccc(nc3s2)c4ccccc4)N | |
| AKOS005250568 | 336.302 | C17 H12 N4 O4 | CYKLYBBOWREKFP-UHFFFAOYSA-N | InChI=1S/C17H12N4O4/c1-21-14(17(23)25-20-21)15(22)18-11-8-6-10(7-9-11)16-19-12-4-2-3-5-13(12)24-16/h2-9H,1H3,(H-,18,19,20,22,23) | C[n+]1c(c(on1)[O-])C(=O)Nc2ccc(cc2)c3nc4ccccc4o3 | |
| AKOS005250792 | 380.381 | C17 H12 N6 O3 S | JXQGAOIVPLQREX-UHFFFAOYSA-N | InChI=1S/C17H12N6O3S/c24-14(15-16(25)26-21-22(15)12-7-3-1-4-8-12)11-27-17-18-19-20-23(17)13-9-5-2-6-10-13/h1-10H,11H2 | c1ccc(cc1)n2c(nnn2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251440 | 438.271 | C17 H13 Br F N3 O3 S | HWTKNOFWDBMBKC-UHFFFAOYSA-N | InChI=1S/C17H13BrFN3O3S/c1-10(15(23)20-14-8-7-11(18)9-13(14)19)26-16-17(24)25-21-22(16)12-5-3-2-4-6-12/h2-10H,1H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccc(cc1F)Br)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252375 | 438.271 | C17 H13 Br F N3 O3 S | NLIKMQNMVKSJFI-UHFFFAOYSA-N | InChI=1S/C17H13BrFN3O3S/c18-11-6-7-14(13(19)10-11)20-15(23)8-9-26-16-17(24)25-21-22(16)12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H-,20,21,23,24) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3F)Br | |
| AKOS005251155 | 454.27 | C17 H13 Br F N3 O4 S | DMPXBPFUXWVLGG-UHFFFAOYSA-N | InChI=1S/C17H13BrFN3O4S/c1-25-12-5-3-11(4-6-12)22-16(17(24)26-21-22)27-9-15(23)20-14-7-2-10(18)8-13(14)19/h2-8H,9H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3F)Br | |
| AKOS005251460 | 393.82 | C17 H13 Cl F N3 O3 S | ZFJIROOXDOMMPD-UHFFFAOYSA-N | InChI=1S/C17H13ClFN3O3S/c1-10(15(23)20-11-7-8-14(19)13(18)9-11)26-16-17(24)25-21-22(16)12-5-3-2-4-6-12/h2-10H,1H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccc(c(c1)Cl)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252293 | 393.82 | C17 H13 Cl F N3 O3 S | CSSJFHJZJUKXMR-UHFFFAOYSA-N | InChI=1S/C17H13ClFN3O3S/c18-13-10-11(6-7-14(13)19)20-15(23)8-9-26-16-17(24)25-21-22(16)12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H-,20,21,23,24) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(c(c3)Cl)F | |
| AKOS005251637 | 409.819 | C17 H13 Cl F N3 O4 S | YQPMIWPYXFMKTD-UHFFFAOYSA-N | InChI=1S/C17H13ClFN3O4S/c1-25-12-5-3-11(4-6-12)22-16(17(24)26-21-22)27-9-15(23)20-10-2-7-14(19)13(18)8-10/h2-8H,9H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(c(c3)Cl)F | |
| AKOS005219494 | 376.814 | C17 H13 Cl N2 O4 S | MPPGDAIBNNUPNV-UHFFFAOYSA-N | InChI=1S/C17H13ClN2O4S/c1-23-13-6-4-12(5-7-13)20-16(17(22)24-19-20)15(21)10-25-14-8-2-11(18)3-9-14/h2-9H,10H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3ccc(cc3)Cl | |
| AKOS005250249 | 378.209 | C17 H13 Cl2 N3 O3 | SOIDJRYVRYMMNP-UHFFFAOYSA-N | InChI=1S/C17H13Cl2N3O3/c1-21(16(23)13-8-7-11(18)9-14(13)19)10-15-17(24)25-20-22(15)12-5-3-2-4-6-12/h2-9H,10H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)c3ccc(cc3Cl)Cl | |
| AKOS005251479 | 410.274 | C17 H13 Cl2 N3 O3 S | SWGRVGIAFSYWKF-UHFFFAOYSA-N | InChI=1S/C17H13Cl2N3O3S/c1-10(15(23)20-13-9-5-8-12(18)14(13)19)26-16-17(24)25-21-22(16)11-6-3-2-4-7-11/h2-10H,1H3,(H-,20,21,23,24) | CC(C(=O)Nc1cccc(c1Cl)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251488 | 410.274 | C17 H13 Cl2 N3 O3 S | QKVSLZZXLRCBJG-UHFFFAOYSA-N | InChI=1S/C17H13Cl2N3O3S/c1-10(15(23)20-14-8-7-11(18)9-13(14)19)26-16-17(24)25-21-22(16)12-5-3-2-4-6-12/h2-10H,1H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccc(cc1Cl)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251489 | 410.274 | C17 H13 Cl2 N3 O3 S | QSBAFFRWVTZMEC-UHFFFAOYSA-N | InChI=1S/C17H13Cl2N3O3S/c1-10(15(23)20-14-9-11(18)7-8-13(14)19)26-16-17(24)25-21-22(16)12-5-3-2-4-6-12/h2-10H,1H3,(H-,20,21,23,24) | CC(C(=O)Nc1cc(ccc1Cl)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251498 | 410.274 | C17 H13 Cl2 N3 O3 S | STUPMTZQESRPDH-UHFFFAOYSA-N | InChI=1S/C17H13Cl2N3O3S/c1-10(15(23)20-11-7-8-13(18)14(19)9-11)26-16-17(24)25-21-22(16)12-5-3-2-4-6-12/h2-10H,1H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccc(c(c1)Cl)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251499 | 410.274 | C17 H13 Cl2 N3 O3 S | FZZAIRNIWCMQID-UHFFFAOYSA-N | InChI=1S/C17H13Cl2N3O3S/c1-10(15(23)20-13-8-11(18)7-12(19)9-13)26-16-17(24)25-21-22(16)14-5-3-2-4-6-14/h2-10H,1H3,(H-,20,21,23,24) | CC(C(=O)Nc1cc(cc(c1)Cl)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252303 | 410.274 | C17 H13 Cl2 N3 O3 S | QVTFXANNMUHEBR-UHFFFAOYSA-N | InChI=1S/C17H13Cl2N3O3S/c18-13-7-6-11(10-14(13)19)20-15(23)8-9-26-16-17(24)25-21-22(16)12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H-,20,21,23,24) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(c(c3)Cl)Cl | |
| AKOS005252304 | 410.274 | C17 H13 Cl2 N3 O3 S | UMCSCPZXDSYZHN-UHFFFAOYSA-N | InChI=1S/C17H13Cl2N3O3S/c18-11-8-12(19)10-13(9-11)20-15(23)6-7-26-16-17(24)25-21-22(16)14-4-2-1-3-5-14/h1-5,8-10H,6-7H2,(H-,20,21,23,24) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cc(cc(c3)Cl)Cl | |
| AKOS005252357 | 410.274 | C17 H13 Cl2 N3 O3 S | WLRWDDWYNHEDGT-UHFFFAOYSA-N | InChI=1S/C17H13Cl2N3O3S/c18-12-7-4-8-13(15(12)19)20-14(23)9-10-26-16-17(24)25-21-22(16)11-5-2-1-3-6-11/h1-8H,9-10H2,(H-,20,21,23,24) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cccc(c3Cl)Cl | |
| AKOS005252386 | 410.274 | C17 H13 Cl2 N3 O3 S | CFQIJWDVEULLFK-UHFFFAOYSA-N | InChI=1S/C17H13Cl2N3O3S/c18-11-6-7-14(13(19)10-11)20-15(23)8-9-26-16-17(24)25-21-22(16)12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H-,20,21,23,24) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3Cl)Cl | |
| AKOS005252387 | 410.274 | C17 H13 Cl2 N3 O3 S | XBVNODSFTFKCAA-UHFFFAOYSA-N | InChI=1S/C17H13Cl2N3O3S/c18-11-6-7-13(19)14(10-11)20-15(23)8-9-26-16-17(24)25-21-22(16)12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H-,20,21,23,24) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cc(ccc3Cl)Cl | |
| AKOS005251528 | 426.274 | C17 H13 Cl2 N3 O4 S | UEESBGLEPLFWLD-UHFFFAOYSA-N | InChI=1S/C17H13Cl2N3O4S/c1-25-12-5-3-11(4-6-12)22-16(17(24)26-21-22)27-9-15(23)20-14-8-10(18)2-7-13(14)19/h2-8H,9H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cc(ccc3Cl)Cl | |
| AKOS005251529 | 426.274 | C17 H13 Cl2 N3 O4 S | YVQGGZFVSRJXTC-UHFFFAOYSA-N | InChI=1S/C17H13Cl2N3O4S/c1-25-12-5-3-11(4-6-12)22-16(17(24)26-21-22)27-9-15(23)20-10-2-7-13(18)14(19)8-10/h2-8H,9H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(c(c3)Cl)Cl | |
| AKOS005251631 | 426.274 | C17 H13 Cl2 N3 O4 S | GWDSRNSCWKBRFR-UHFFFAOYSA-N | InChI=1S/C17H13Cl2N3O4S/c1-25-14-4-2-13(3-5-14)22-16(17(24)26-21-22)27-9-15(23)20-12-7-10(18)6-11(19)8-12/h2-8H,9H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cc(cc(c3)Cl)Cl | |
| AKOS005251653 | 426.274 | C17 H13 Cl2 N3 O4 S | NDFMMCAWQWFVDI-UHFFFAOYSA-N | InChI=1S/C17H13Cl2N3O4S/c1-25-11-7-5-10(6-8-11)22-16(17(24)26-21-22)27-9-14(23)20-13-4-2-3-12(18)15(13)19/h2-8H,9H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cccc(c3Cl)Cl | |
| AKOS005251654 | 426.274 | C17 H13 Cl2 N3 O4 S | UIGIALJUDZAXDC-UHFFFAOYSA-N | InChI=1S/C17H13Cl2N3O4S/c1-25-12-5-3-11(4-6-12)22-16(17(24)26-21-22)27-9-15(23)20-14-7-2-10(18)8-13(14)19/h2-8H,9H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3Cl)Cl | |
| AKOS005251776 | 377.365 | C17 H13 F2 N3 O3 S | KPXZQUJOWSGIBW-UHFFFAOYSA-N | InChI=1S/C17H13F2N3O3S/c1-10(15(23)20-11-7-8-13(18)14(19)9-11)26-16-17(24)25-21-22(16)12-5-3-2-4-6-12/h2-10H,1H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccc(c(c1)F)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252175 | 377.365 | C17 H13 F2 N3 O3 S | PEEYASHDBTTZFP-UHFFFAOYSA-N | InChI=1S/C17H13F2N3O3S/c18-13-7-6-11(10-14(13)19)20-15(23)8-9-26-16-17(24)25-21-22(16)12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H-,20,21,23,24) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(c(c3)F)F | |
| AKOS005251615 | 393.365 | C17 H13 F2 N3 O4 S | GTECWRWLIUVVMA-UHFFFAOYSA-N | InChI=1S/C17H13F2N3O4S/c1-25-12-5-3-11(4-6-12)22-16(17(24)26-21-22)27-9-15(23)20-10-2-7-13(18)14(19)8-10/h2-8H,9H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(c(c3)F)F | |
| AKOS005252745 | 454.449 | C17 H13 F3 N6 O2 S2 | ZOBVOLCYMFUHJL-UHFFFAOYSA-N | InChI=1S/C17H13F3N6O2S2/c1-25(2)26-8-15(28-24-26)23-14(27)9-30-16-10(7-21)11(17(18,19)20)6-12(22-16)13-4-3-5-29-13/h3-6,8H,9H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3cccs3)C(F)(F)F)C#N | |
| AKOS005215647 | 307.303 | C17 H13 N3 O3 | GWOZHNWRLBXTAO-UHFFFAOYSA-N | InChI=1S/C17H13N3O3/c21-17-16(20(19-23-17)13-9-5-2-6-10-13)14-11-22-18-15(14)12-7-3-1-4-8-12/h1-10,14H,11H2 | c1ccc(cc1)C2=NOCC2c3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251340 | 371.433 | C17 H13 N3 O3 S2 | RWSNXGYQCBWZNC-UHFFFAOYSA-N | InChI=1S/C17H13N3O3S2/c1-19-16(17(22)23-18-19)24-10-15(21)20-11-6-2-4-8-13(11)25-14-9-5-3-7-12(14)20/h2-9H,10H2,1H3 | C[n+]1c(c(on1)[O-])SCC(=O)N2c3ccccc3Sc4c2cccc4 | |
| AKOS005251178 | 371.367 | C17 H13 N3 O5 S | ROPLJNBQZYSMAO-UHFFFAOYSA-N | InChI=1S/C17H13N3O5S/c21-14(18-12-8-6-11(7-9-12)16(22)23)10-26-15-17(24)25-19-20(15)13-4-2-1-3-5-13/h1-9H,10H2,(H2-,18,19,21,22,23,24) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)C(=O)O | |
| AKOS005251185 | 371.367 | C17 H13 N3 O5 S | YIQBDAHUVQBVGM-UHFFFAOYSA-N | InChI=1S/C17H13N3O5S/c21-14(18-12-6-4-5-11(9-12)16(22)23)10-26-15-17(24)25-19-20(15)13-7-2-1-3-8-13/h1-9H,10H2,(H2-,18,19,21,22,23,24) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cccc(c3)C(=O)O | |
| AKOS005251211 | 371.367 | C17 H13 N3 O5 S | OWCVANFPWVLDNH-UHFFFAOYSA-N | InChI=1S/C17H13N3O5S/c21-15(18-11-6-7-13-14(8-11)24-10-23-13)9-26-16-17(22)25-19-20(16)12-4-2-1-3-5-12/h1-8H,9-10H2,(H-,18,19,21,22) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc4c(c3)OCO4 | |
| AKOS005250153 | 355.302 | C17 H13 N3 O6 | GWLLSUODWRTKOG-UHFFFAOYSA-N | InChI=1S/C17H13N3O6/c1-23-12-5-3-11(4-6-12)20-15(17(22)26-19-20)16(21)18-10-2-7-13-14(8-10)25-9-24-13/h2-8H,9H2,1H3,(H-,18,19,21,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc4c(c3)OCO4 | |
| AKOS005250168 | 355.302 | C17 H13 N3 O6 | PVMMETYSMSRDJG-UHFFFAOYSA-N | InChI=1S/C17H13N3O6/c1-25-13-8-6-12(7-9-13)20-14(17(24)26-19-20)15(21)18-11-4-2-10(3-5-11)16(22)23/h2-9H,1H3,(H2-,18,19,21,22,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(cc3)C(=O)O | |
| AKOS005250175 | 355.302 | C17 H13 N3 O6 | ITFCAQFWTULFHL-UHFFFAOYSA-N | InChI=1S/C17H13N3O6/c1-25-13-7-5-12(6-8-13)20-14(17(24)26-19-20)15(21)18-11-4-2-3-10(9-11)16(22)23/h2-9H,1H3,(H2-,18,19,21,22,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3cccc(c3)C(=O)O | |
| AKOS005251163 | 387.367 | C17 H13 N3 O6 S | FMOXNQFTQMRICK-UHFFFAOYSA-N | InChI=1S/C17H13N3O6S/c21-13-7-6-10(8-12(13)16(23)24)18-14(22)9-27-15-17(25)26-19-20(15)11-4-2-1-3-5-11/h1-8,19H,9H2,(H2,23,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(c(c3)C(=O)O)O | |
| AKOS005250216 | 371.301 | C17 H13 N3 O7 | FZOYUIDDQKOJIT-UHFFFAOYSA-N | InChI=1S/C17H13N3O7/c1-26-11-5-3-10(4-6-11)20-14(17(25)27-19-20)15(22)18-9-2-7-13(21)12(8-9)16(23)24/h2-8,19H,1H3,(H2,22,23,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(c(c3)C(=O)O)O | |
| AKOS005251472 | 385.374 | C17 H13 N4 O5 S | UTBULFGKBVWZNK-UHFFFAOYSA-M | InChI=1S/C17H14N4O5S/c1-11(15(22)18-12-7-9-14(10-8-12)21(24)25)27-16-17(23)26-19-20(16)13-5-3-2-4-6-13/h2-7,9-11,23H,1H3,(H,18,22)/p-1 | CC(C(=O)Nc1ccc(c[c-]1)[N+](=O)[O-])Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252336 | 385.374 | C17 H13 N4 O5 S | MEWMWQGBPUNGAB-UHFFFAOYSA-M | InChI=1S/C17H14N4O5S/c22-15(18-12-6-8-14(9-7-12)21(24)25)10-11-27-16-17(23)26-19-20(16)13-4-2-1-3-5-13/h1-6,8-9,23H,10-11H2,(H,18,22)/p-1 | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(c[c-]3)[N+](=O)[O-] | |
| AKOS005251530 | 401.373 | C17 H13 N4 O6 S | QLTSNVUPKXCNII-UHFFFAOYSA-M | InChI=1S/C17H14N4O6S/c1-26-14-8-6-12(7-9-14)20-16(17(23)27-19-20)28-10-15(22)18-11-2-4-13(5-3-11)21(24)25/h2,4-9,23H,10H2,1H3,(H,18,22)/p-1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(c[c-]3)[N+](=O)[O-] | |
| AKOS005219567 | 351.382 | C17 H13 N5 O2 S | IDFMICBVVHWKLR-UHFFFAOYSA-N | InChI=1S/C17H13N5O2S/c1-22-10-16(24-21-22)20-15(23)11-25-17-13(9-18)7-8-14(19-17)12-5-3-2-4-6-12/h2-8,10H,11H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)c3ccccc3)C#N | |
| AKOS005250554 | 383.381 | C17 H13 N5 O4 S | RMMJPYCKCRNAPK-UHFFFAOYSA-N | InChI=1S/C17H13N5O4S/c1-9-11(8-18)16(20-14(23)12-17(25)26-21-22(12)2)27-13(9)15(24)19-10-6-4-3-5-7-10/h3-7H,1-2H3,(H2-,19,20,21,23,24,25) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)c3c(on[n+]3C)[O-])C#N | |
| AKOS005252932 | 411.461 | C17 H13 N7 O2 S2 | PGBOQJUSILSWMT-UHFFFAOYSA-N | InChI=1S/C17H13N7O2S2/c1-2-24-8-14(26-23-24)21-13(25)9-28-17-11(7-19)15(12-4-3-5-27-12)10(6-18)16(20)22-17/h3-5,8H,2,9H2,1H3,(H2-,20,21,22,23,25) | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3cccs3)C#N | |
| AKOS005252797 | 395.395 | C17 H13 N7 O3 S | NRXONDWVXXFRNO-UHFFFAOYSA-N | InChI=1S/C17H13N7O3S/c1-2-24-8-14(27-23-24)21-13(25)9-28-17-11(7-19)15(12-4-3-5-26-12)10(6-18)16(20)22-17/h3-5,8H,2,9H2,1H3,(H2-,20,21,22,23,25) | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3ccco3)C#N | |
| AKOS005251430 | 420.28 | C17 H14 Br N3 O3 S | NCUKHODIZOGQJD-UHFFFAOYSA-N | InChI=1S/C17H14BrN3O3S/c1-11(15(22)19-14-10-6-5-9-13(14)18)25-16-17(23)24-20-21(16)12-7-3-2-4-8-12/h2-11H,1H3,(H-,19,20,22,23) | CC(C(=O)Nc1ccccc1Br)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251439 | 420.28 | C17 H14 Br N3 O3 S | XQRAPFSYOYIESH-UHFFFAOYSA-N | InChI=1S/C17H14BrN3O3S/c1-11(15(22)19-13-9-7-12(18)8-10-13)25-16-17(23)24-20-21(16)14-5-3-2-4-6-14/h2-11H,1H3,(H-,19,20,22,23) | CC(C(=O)Nc1ccc(cc1)Br)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252365 | 420.28 | C17 H14 Br N3 O3 S | CBWKFJUEPQMIJD-UHFFFAOYSA-N | InChI=1S/C17H14BrN3O3S/c18-13-8-4-5-9-14(13)19-15(22)10-11-25-16-17(23)24-20-21(16)12-6-2-1-3-7-12/h1-9H,10-11H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccccc3Br | |
| AKOS005252374 | 420.28 | C17 H14 Br N3 O3 S | QNMDKXNVWUZREH-UHFFFAOYSA-N | InChI=1S/C17H14BrN3O3S/c18-12-6-8-13(9-7-12)19-15(22)10-11-25-16-17(23)24-20-21(16)14-4-2-1-3-5-14/h1-9H,10-11H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)Br | |
| AKOS005251195 | 436.28 | C17 H14 Br N3 O4 S | FIVMZRJKTJNVAE-UHFFFAOYSA-N | InChI=1S/C17H14BrN3O4S/c1-24-12-8-6-11(7-9-12)21-16(17(23)25-20-21)26-10-15(22)19-14-5-3-2-4-13(14)18/h2-9H,10H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccccc3Br | |
| AKOS005251196 | 436.28 | C17 H14 Br N3 O4 S | SUTMZRKNMMOESC-UHFFFAOYSA-N | InChI=1S/C17H14BrN3O4S/c1-24-14-8-6-13(7-9-14)21-16(17(23)25-20-21)26-10-15(22)19-12-4-2-11(18)3-5-12/h2-9H,10H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)Br | |
| AKOS005250250 | 343.764 | C17 H14 Cl N3 O3 | NNNLVOMHMBHXJM-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O3/c1-20(16(22)12-6-5-7-13(18)10-12)11-15-17(23)24-19-21(15)14-8-3-2-4-9-14/h2-10H,11H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)c3cccc(c3)Cl | |
| AKOS005251150 | 375.829 | C17 H14 Cl N3 O3 S | TXNYLIHAVDNXDC-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O3S/c1-11-13(18)8-5-9-14(11)19-15(22)10-25-16-17(23)24-20-21(16)12-6-3-2-4-7-12/h2-9H,10H2,1H3,(H-,19,20,22,23) | Cc1c(cccc1Cl)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251157 | 375.829 | C17 H14 Cl N3 O3 S | UFEIGDZYJSZKRM-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O3S/c1-11-7-8-12(9-14(11)18)19-15(22)10-25-16-17(23)24-20-21(16)13-5-3-2-4-6-13/h2-9H,10H2,1H3,(H-,19,20,22,23) | Cc1ccc(cc1Cl)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251158 | 375.829 | C17 H14 Cl N3 O3 S | XIAZYQDYLIWVPW-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O3S/c1-11-7-8-12(18)9-14(11)19-15(22)10-25-16-17(23)24-20-21(16)13-5-3-2-4-6-13/h2-9H,10H2,1H3,(H-,19,20,22,23) | Cc1ccc(cc1NC(=O)CSc2c(on[n+]2c3ccccc3)[O-])Cl | |
| AKOS005251449 | 375.829 | C17 H14 Cl N3 O3 S | XTQWFQKIGOQNSU-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O3S/c1-11(15(22)19-14-10-6-5-9-13(14)18)25-16-17(23)24-20-21(16)12-7-3-2-4-8-12/h2-11H,1H3,(H-,19,20,22,23) | CC(C(=O)Nc1ccccc1Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251450 | 375.829 | C17 H14 Cl N3 O3 S | NJWIBRILHUEIQD-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O3S/c1-11(15(22)19-13-7-5-6-12(18)10-13)25-16-17(23)24-20-21(16)14-8-3-2-4-9-14/h2-11H,1H3,(H-,19,20,22,23) | CC(C(=O)Nc1cccc(c1)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251459 | 375.829 | C17 H14 Cl N3 O3 S | SJOYRFPEFKJVGW-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O3S/c1-11(15(22)19-13-9-7-12(18)8-10-13)25-16-17(23)24-20-21(16)14-5-3-2-4-6-14/h2-11H,1H3,(H-,19,20,22,23) | CC(C(=O)Nc1ccc(cc1)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252292 | 375.829 | C17 H14 Cl N3 O3 S | UXOVPEYXRJAUOG-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O3S/c18-12-6-8-13(9-7-12)19-15(22)10-11-25-16-17(23)24-20-21(16)14-4-2-1-3-5-14/h1-9H,10-11H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)Cl | |
| AKOS005252384 | 375.829 | C17 H14 Cl N3 O3 S | MYFYMHXLLIGAAX-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O3S/c18-13-8-4-5-9-14(13)19-15(22)10-11-25-16-17(23)24-20-21(16)12-6-2-1-3-7-12/h1-9H,10-11H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccccc3Cl | |
| AKOS005252385 | 375.829 | C17 H14 Cl N3 O3 S | IJKXRDNRSGKHJC-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O3S/c18-12-5-4-6-13(11-12)19-15(22)9-10-25-16-17(23)24-20-21(16)14-7-2-1-3-8-14/h1-8,11H,9-10H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cccc(c3)Cl | |
| AKOS005250117 | 359.764 | C17 H14 Cl N3 O4 | CKZNAFCJYXTCHZ-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O4/c1-10-13(18)4-3-5-14(10)19-16(22)15-17(23)25-20-21(15)11-6-8-12(24-2)9-7-11/h3-9H,1-2H3,(H-,19,20,22,23) | Cc1c(cccc1Cl)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250190 | 359.764 | C17 H14 Cl N3 O4 | VONIPNDLVIXWIJ-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O4/c1-24-13-8-6-12(7-9-13)21-15(17(23)25-20-21)16(22)19-10-11-4-2-3-5-14(11)18/h2-9H,10H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCc3ccccc3Cl | |
| AKOS005250222 | 359.764 | C17 H14 Cl N3 O4 | MLXQPOJOSGYXJH-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O4/c1-10-3-4-11(9-14(10)18)19-16(22)15-17(23)25-20-21(15)12-5-7-13(24-2)8-6-12/h3-9H,1-2H3,(H-,19,20,22,23) | Cc1ccc(cc1Cl)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250223 | 359.764 | C17 H14 Cl N3 O4 | QVMRERZPNIZOCN-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O4/c1-10-3-4-11(18)9-14(10)19-16(22)15-17(23)25-20-21(15)12-5-7-13(24-2)8-6-12/h3-9H,1-2H3,(H-,19,20,22,23) | Cc1ccc(cc1NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])Cl | |
| AKOS005251156 | 391.829 | C17 H14 Cl N3 O4 S | HNWYUVXJCMEFOD-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O4S/c1-24-12-8-6-11(7-9-12)21-16(17(23)25-20-21)26-10-15(22)19-14-5-3-2-4-13(14)18/h2-9H,10H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccccc3Cl | |
| AKOS005251186 | 391.829 | C17 H14 Cl N3 O4 S | QGCAWEBHJIQZCR-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O4S/c1-24-14-8-7-11(9-13(14)18)19-15(22)10-26-16-17(23)25-20-21(16)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1Cl)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251193 | 391.829 | C17 H14 Cl N3 O4 S | PIDJQFHXGHFGBE-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O4S/c1-24-14-8-7-11(18)9-13(14)19-15(22)10-26-16-17(23)25-20-21(16)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1NC(=O)CSc2c(on[n+]2c3ccccc3)[O-])Cl | |
| AKOS005251629 | 391.829 | C17 H14 Cl N3 O4 S | MIFKTHIMUXAPPA-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O4S/c1-24-14-7-5-13(6-8-14)21-16(17(23)25-20-21)26-10-15(22)19-12-4-2-3-11(18)9-12/h2-9H,10H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cccc(c3)Cl | |
| AKOS005251630 | 391.829 | C17 H14 Cl N3 O4 S | CHJSBLPFHGWARO-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O4S/c1-24-14-8-6-13(7-9-14)21-16(17(23)25-20-21)26-10-15(22)19-12-4-2-11(18)3-5-12/h2-9H,10H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)Cl | |
| AKOS005250176 | 375.763 | C17 H14 Cl N3 O5 | QGDHBMQXUGIJSK-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O5/c1-24-12-6-4-11(5-7-12)21-15(17(23)26-20-21)16(22)19-10-3-8-14(25-2)13(18)9-10/h3-9H,1-2H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(c(c3)Cl)OC | |
| AKOS005250183 | 375.763 | C17 H14 Cl N3 O5 | SGOILRRCKIBMLX-UHFFFAOYSA-N | InChI=1S/C17H14ClN3O5/c1-24-12-6-4-11(5-7-12)21-15(17(23)26-20-21)16(22)19-13-9-10(18)3-8-14(13)25-2/h3-9H,1-2H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3cc(ccc3OC)Cl | |
| AKOS005250380 | 327.31 | C17 H14 F N3 O3 | CULYTHVJQBXSNO-UHFFFAOYSA-N | InChI=1S/C17H14FN3O3/c1-20(16(22)13-9-5-6-10-14(13)18)11-15-17(23)24-19-21(15)12-7-3-2-4-8-12/h2-10H,11H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)c3ccccc3F | |
| AKOS005250381 | 327.31 | C17 H14 F N3 O3 | BZPXKIZANKHOBL-UHFFFAOYSA-N | InChI=1S/C17H14FN3O3/c1-20(16(22)12-7-9-13(18)10-8-12)11-15-17(23)24-19-21(15)14-5-3-2-4-6-14/h2-10H,11H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)c3ccc(cc3)F | |
| AKOS005251890 | 359.375 | C17 H14 F N3 O3 S | FFUMITNGQGRIGM-UHFFFAOYSA-N | InChI=1S/C17H14FN3O3S/c1-11(15(22)19-14-10-6-5-9-13(14)18)25-16-17(23)24-20-21(16)12-7-3-2-4-8-12/h2-11H,1H3,(H-,19,20,22,23) | CC(C(=O)Nc1ccccc1F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251891 | 359.375 | C17 H14 F N3 O3 S | UZGJMNKANBIUNT-UHFFFAOYSA-N | InChI=1S/C17H14FN3O3S/c1-11(15(22)19-13-9-7-12(18)8-10-13)25-16-17(23)24-20-21(16)14-5-3-2-4-6-14/h2-11H,1H3,(H-,19,20,22,23) | CC(C(=O)Nc1ccc(cc1)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252248 | 359.375 | C17 H14 F N3 O3 S | HUPUIFCSTCWWSI-UHFFFAOYSA-N | InChI=1S/C17H14FN3O3S/c18-13-8-4-5-9-14(13)19-15(22)10-11-25-16-17(23)24-20-21(16)12-6-2-1-3-7-12/h1-9H,10-11H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccccc3F | |
| AKOS005252249 | 359.375 | C17 H14 F N3 O3 S | APDFKYBWULJRFI-UHFFFAOYSA-N | InChI=1S/C17H14FN3O3S/c18-12-6-8-13(9-7-12)19-15(22)10-11-25-16-17(23)24-20-21(16)14-4-2-1-3-5-14/h1-9H,10-11H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)F | |
| AKOS005250149 | 343.309 | C17 H14 F N3 O4 | DPQNSNFHBYRXPE-UHFFFAOYSA-N | InChI=1S/C17H14FN3O4/c1-24-14-8-6-13(7-9-14)21-15(17(23)25-20-21)16(22)19-10-11-2-4-12(18)5-3-11/h2-9H,10H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCc3ccc(cc3)F | |
| AKOS005251539 | 375.374 | C17 H14 F N3 O4 S | BPDVGAULDVOZBU-UHFFFAOYSA-N | InChI=1S/C17H14FN3O4S/c1-24-12-8-6-11(7-9-12)21-16(17(23)25-20-21)26-10-15(22)19-14-5-3-2-4-13(14)18/h2-9H,10H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccccc3F | |
| AKOS005251540 | 375.374 | C17 H14 F N3 O4 S | OUHYLQYPQZMXBE-UHFFFAOYSA-N | InChI=1S/C17H14FN3O4S/c1-24-14-8-6-13(7-9-14)21-16(17(23)25-20-21)26-10-15(22)19-12-4-2-11(18)3-5-12/h2-9H,10H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)F | |
| AKOS005251764 | 467.281 | C17 H14 I N3 O3 S | XZEDVOPFUNSRDB-UHFFFAOYSA-N | InChI=1S/C17H14IN3O3S/c1-11(15(22)19-13-9-7-12(18)8-10-13)25-16-17(23)24-20-21(16)14-5-3-2-4-6-14/h2-11H,1H3,(H-,19,20,22,23) | CC(C(=O)Nc1ccc(cc1)I)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252256 | 467.281 | C17 H14 I N3 O3 S | JGCRYTLSSZZTSH-UHFFFAOYSA-N | InChI=1S/C17H14IN3O3S/c18-12-6-8-13(9-7-12)19-15(22)10-11-25-16-17(23)24-20-21(16)14-4-2-1-3-5-14/h1-9H,10-11H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)I | |
| AKOS005251541 | 483.28 | C17 H14 I N3 O4 S | VLFNKOGHMBQGQZ-UHFFFAOYSA-N | InChI=1S/C17H14IN3O4S/c1-24-14-8-6-13(7-9-14)21-16(17(23)25-20-21)26-10-15(22)19-12-4-2-11(18)3-5-12/h2-9H,10H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)I | |
| AKOS005250793 | 326.37 | C17 H14 N2 O3 S | ZPNBZNPTGZSGBQ-UHFFFAOYSA-N | InChI=1S/C17H14N2O3S/c20-15(12-23-11-13-7-3-1-4-8-13)16-17(21)22-18-19(16)14-9-5-2-6-10-14/h1-10H,11-12H2 | c1ccc(cc1)CSCC(=O)c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250796 | 326.37 | C17 H14 N2 O3 S | IAGNOLJOXGPSDY-UHFFFAOYSA-N | InChI=1S/C17H14N2O3S/c1-12-7-9-14(10-8-12)23-11-15(20)16-17(21)22-18-19(16)13-5-3-2-4-6-13/h2-10H,11H2,1H3 | Cc1ccc(cc1)SCC(=O)c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250413 | 342.369 | C17 H14 N2 O4 S | NWYHTFRJRPOLFG-UHFFFAOYSA-N | InChI=1S/C17H14N2O4S/c1-22-13-9-7-12(8-10-13)19-16(17(21)23-18-19)15(20)11-24-14-5-3-2-4-6-14/h2-10H,11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3ccccc3 | |
| AKOS005219799 | 338.317 | C17 H14 N4 O4 | IDDWVPWQAYFSBX-UHFFFAOYSA-N | InChI=1S/C17H14N4O4/c1-9(22)13-10(2)24-16(19)12(8-18)14(13)15-17(23)25-20-21(15)11-6-4-3-5-7-11/h3-7,14H,19H2,1-2H3 | CC1=C(C(C(=C(O1)N)C#N)c2c(on[n+]2c3ccccc3)[O-])C(=O)C | |
| AKOS005251138 | 370.382 | C17 H14 N4 O4 S | RJHJQXLJZZHMEY-UHFFFAOYSA-N | InChI=1S/C17H14N4O4S/c18-15(23)12-8-4-5-9-13(12)19-14(22)10-26-16-17(24)25-20-21(16)11-6-2-1-3-7-11/h1-9H,10H2,(H3-,18,19,20,22,23,24) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccccc3C(=O)N | |
| AKOS005251210 | 370.382 | C17 H14 N4 O4 S | HTQQCOOWCPCRHQ-UHFFFAOYSA-N | InChI=1S/C17H14N4O4S/c18-15(23)11-6-8-12(9-7-11)19-14(22)10-26-16-17(24)25-20-21(16)13-4-2-1-3-5-13/h1-9H,10H2,(H3-,18,19,20,22,23,24) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)C(=O)N | |
| AKOS005250200 | 354.317 | C17 H14 N4 O5 | IUHOYWBBPIEVKP-UHFFFAOYSA-N | InChI=1S/C17H14N4O5/c1-25-13-8-6-12(7-9-13)21-14(17(24)26-20-21)16(23)19-11-4-2-10(3-5-11)15(18)22/h2-9H,1H3,(H3-,18,19,20,22,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(cc3)C(=O)N | |
| AKOS005250207 | 354.317 | C17 H14 N4 O5 | JWIOYFLTJRGOQA-UHFFFAOYSA-N | InChI=1S/C17H14N4O5/c1-25-11-8-6-10(7-9-11)21-14(17(24)26-20-21)16(23)19-13-5-3-2-4-12(13)15(18)22/h2-9H,1H3,(H3-,18,19,20,22,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccccc3C(=O)N | |
| AKOS005250251 | 354.317 | C17 H14 N4 O5 | NMCVSLLSGUCTLK-UHFFFAOYSA-N | InChI=1S/C17H14N4O5/c1-19(16(22)12-6-5-9-14(10-12)21(24)25)11-15-17(23)26-18-20(15)13-7-3-2-4-8-13/h2-10H,11H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)c3cccc(c3)[N+](=O)[O-] | |
| AKOS005250252 | 354.317 | C17 H14 N4 O5 | BWJBUUIMVLWHJZ-UHFFFAOYSA-N | InChI=1S/C17H14N4O5/c1-19(16(22)12-7-9-14(10-8-12)21(24)25)11-15-17(23)26-18-20(15)13-5-3-2-4-6-13/h2-10H,11H2,1H3/q-2 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)c3ccc(cc3)[N-](=O)[O-] | |
| AKOS005251146 | 386.382 | C17 H14 N4 O5 S | QMJMJYAZMKCVDA-UHFFFAOYSA-N | InChI=1S/C17H14N4O5S/c1-11-9-13(21(24)25)7-8-14(11)18-15(22)10-27-16-17(23)26-19-20(16)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H-,18,19,22,23) | Cc1cc(ccc1NC(=O)CSc2c(on[n+]2c3ccccc3)[O-])[N+](=O)[O-] | |
| AKOS005251153 | 386.382 | C17 H14 N4 O5 S | QDWYFAIUBCSTFD-UHFFFAOYSA-N | InChI=1S/C17H14N4O5S/c1-11-7-8-13(21(24)25)9-14(11)18-15(22)10-27-16-17(23)26-19-20(16)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H-,18,19,22,23) | Cc1ccc(cc1NC(=O)CSc2c(on[n+]2c3ccccc3)[O-])[N+](=O)[O-] | |
| AKOS005250139 | 370.316 | C17 H14 N4 O6 | DEMDTFMFQGBGKK-UHFFFAOYSA-N | InChI=1S/C17H14N4O6/c1-10-9-12(21(24)25)5-8-14(10)18-16(22)15-17(23)27-19-20(15)11-3-6-13(26-2)7-4-11/h3-9H,1-2H3,(H-,18,19,22,23) | Cc1cc(ccc1NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])[N+](=O)[O-] | |
| AKOS005250143 | 370.316 | C17 H14 N4 O6 | GVLUKKCSGMNIBX-UHFFFAOYSA-N | InChI=1S/C17H14N4O6/c1-10-3-4-12(21(24)25)9-14(10)18-16(22)15-17(23)27-19-20(15)11-5-7-13(26-2)8-6-11/h3-9H,1-2H3,(H-,18,19,22,23) | Cc1ccc(cc1NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])[N+](=O)[O-] | |
| AKOS005219748 | 350.331 | C17 H14 N6 O3 | GJDDZWHPMYDZIM-UHFFFAOYSA-N | InChI=1S/C17H14N6O3/c1-9-12-13(14-17(24)26-21-22(14)2)11(8-18)15(19)25-16(12)23(20-9)10-6-4-3-5-7-10/h3-7,13H,19H2,1-2H3 | Cc1c2c(n(n1)c3ccccc3)OC(=C(C2c4c(on[n+]4C)[O-])C#N)N | |
| AKOS005252754 | 426.475 | C17 H14 N8 O2 S2 | MPNUPKFDBZDWLT-UHFFFAOYSA-N | InChI=1S/C17H14N8O2S2/c1-24(2)25-8-14(27-23-25)21-13(26)9-29-17-11(7-19)15(12-4-3-5-28-12)10(6-18)16(20)22-17/h3-5,8H,9H2,1-2H3,(H2-,20,21,22,23,26) | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3cccs3)C#N | |
| AKOS005252755 | 410.41 | C17 H14 N8 O3 S | PKXMVIAHGLEVQA-UHFFFAOYSA-N | InChI=1S/C17H14N8O3S/c1-24(2)25-8-14(28-23-25)21-13(26)9-29-17-11(7-19)15(12-4-3-5-27-12)10(6-18)16(20)22-17/h3-5,8H,9H2,1-2H3,(H2-,20,21,22,23,26) | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3ccco3)C#N | |
| AKOS005214791 | 364.226 | C17 H15 Cl2 N3 O2 | VAIKYDGFWMQLHV-UHFFFAOYSA-N | InChI=1S/C17H15Cl2N3O2/c18-13-7-6-12(15(19)10-13)8-9-20-11-16-17(23)24-21-22(16)14-4-2-1-3-5-14/h1-7,10,20H,8-9,11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccc(cc3Cl)Cl | |
| AKOS005250284 | 341.384 | C17 H15 N3 O3 S | HJUAXQIADIAHOE-UHFFFAOYSA-N | InChI=1S/C17H15N3O3S/c21-16(15-7-4-10-24-15)19(12-8-9-12)11-14-17(22)23-18-20(14)13-5-2-1-3-6-13/h1-7,10,12H,8-9,11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4cccs4 | |
| AKOS005250333 | 341.384 | C17 H15 N3 O3 S | OKTLJEACCUBMNB-UHFFFAOYSA-N | InChI=1S/C17H15N3O3S/c21-16(12-8-9-24-11-12)19(13-6-7-13)10-15-17(22)23-18-20(15)14-4-2-1-3-5-14/h1-5,8-9,11,13H,6-7,10H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4ccsc4 | |
| AKOS005251206 | 341.384 | C17 H15 N3 O3 S | WCAJLTMFGSTUHY-UHFFFAOYSA-N | InChI=1S/C17H15N3O3S/c1-12-7-5-6-10-14(12)18-15(21)11-24-16-17(22)23-19-20(16)13-8-3-2-4-9-13/h2-10H,11H2,1H3,(H-,18,19,21,22) | Cc1ccccc1NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251213 | 341.384 | C17 H15 N3 O3 S | RHVQWAASPCQIQE-UHFFFAOYSA-N | InChI=1S/C17H15N3O3S/c1-12-6-5-7-13(10-12)18-15(21)11-24-16-17(22)23-19-20(16)14-8-3-2-4-9-14/h2-10H,11H2,1H3,(H-,18,19,21,22) | Cc1cccc(c1)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251214 | 341.384 | C17 H15 N3 O3 S | FNHPBEBOHXZEIB-UHFFFAOYSA-N | InChI=1S/C17H15N3O3S/c1-12-7-9-13(10-8-12)18-15(21)11-24-16-17(22)23-19-20(16)14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H-,18,19,21,22) | Cc1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251419 | 341.384 | C17 H15 N3 O3 S | DMEJUZTVYMOGDK-UHFFFAOYSA-N | InChI=1S/C17H15N3O3S/c1-12(15(21)18-13-8-4-2-5-9-13)24-16-17(22)23-19-20(16)14-10-6-3-7-11-14/h2-12H,1H3,(H-,18,19,21,22) | CC(C(=O)Nc1ccccc1)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252354 | 341.384 | C17 H15 N3 O3 S | WKNVNDYPGBPORV-UHFFFAOYSA-N | InChI=1S/C17H15N3O3S/c21-15(18-13-7-3-1-4-8-13)11-12-24-16-17(22)23-19-20(16)14-9-5-2-6-10-14/h1-10H,11-12H2,(H-,18,19,21,22) | c1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005214183 | 325.319 | C17 H15 N3 O4 | JQDKXXKJRPSULH-UHFFFAOYSA-N | InChI=1S/C17H15N3O4/c21-17-14(20(19-24-17)13-4-2-1-3-5-13)10-18-9-12-6-7-15-16(8-12)23-11-22-15/h1-8,18H,9-11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3ccc4c(c3)OCO4 | |
| AKOS005250120 | 325.319 | C17 H15 N3 O4 | HRRFVVFZPMSVKF-UHFFFAOYSA-N | InChI=1S/C17H15N3O4/c1-11-4-3-5-12(10-11)18-16(21)15-17(22)24-19-20(15)13-6-8-14(23-2)9-7-13/h3-10H,1-2H3,(H-,18,19,21,22) | Cc1cccc(c1)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250121 | 325.319 | C17 H15 N3 O4 | RRHZGMGKZDLFAZ-UHFFFAOYSA-N | InChI=1S/C17H15N3O4/c1-11-3-5-12(6-4-11)18-16(21)15-17(22)24-19-20(15)13-7-9-14(23-2)10-8-13/h3-10H,1-2H3,(H-,18,19,21,22) | Cc1ccc(cc1)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250198 | 325.319 | C17 H15 N3 O4 | XNBVHBGLTATUFF-UHFFFAOYSA-N | InChI=1S/C17H15N3O4/c1-23-14-9-7-13(8-10-14)20-15(17(22)24-19-20)16(21)18-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H-,18,19,21,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCc3ccccc3 | |
| AKOS005250242 | 325.319 | C17 H15 N3 O4 | ZWXZNQSYZDEXBZ-UHFFFAOYSA-N | InChI=1S/C17H15N3O4/c1-11-5-3-4-6-14(11)18-16(21)15-17(22)24-19-20(15)12-7-9-13(23-2)10-8-12/h3-10H,1-2H3,(H-,18,19,21,22) | Cc1ccccc1NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250300 | 325.319 | C17 H15 N3 O4 | KDQCQWJVZOXZFK-UHFFFAOYSA-N | InChI=1S/C17H15N3O4/c21-16(15-7-4-10-23-15)19(12-8-9-12)11-14-17(22)24-18-20(14)13-5-2-1-3-6-13/h1-7,10,12H,8-9,11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4ccco4 | |
| AKOS005250781 | 357.384 | C17 H15 N3 O4 S | PHEKYXQCCRXLSH-UHFFFAOYSA-N | InChI=1S/C17H15N3O4S/c1-23-13-7-5-12(6-8-13)20-16(17(22)24-19-20)15(21)10-25-14-4-2-3-11(18)9-14/h2-9H,10,18H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3cccc(c3)N | |
| AKOS005251112 | 357.384 | C17 H15 N3 O4 S | SWVWEOYLJCWPCX-UHFFFAOYSA-N | InChI=1S/C17H15N3O4S/c1-20-16(17(22)24-19-20)25-11-15(21)18-12-7-9-14(10-8-12)23-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H-,18,19,21,22) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)Oc3ccccc3 | |
| AKOS005251192 | 357.384 | C17 H15 N3 O4 S | MHRJFQHLXQLCJV-UHFFFAOYSA-N | InChI=1S/C17H15N3O4S/c1-23-14-10-6-5-9-13(14)18-15(21)11-25-16-17(22)24-19-20(16)12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H-,18,19,21,22) | COc1ccccc1NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251199 | 357.384 | C17 H15 N3 O4 S | YPDGOXKEBHZURS-UHFFFAOYSA-N | InChI=1S/C17H15N3O4S/c1-23-14-9-5-6-12(10-14)18-15(21)11-25-16-17(22)24-19-20(16)13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H-,18,19,21,22) | COc1cccc(c1)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251200 | 357.384 | C17 H15 N3 O4 S | WCRZWLJMXQPNKT-UHFFFAOYSA-N | InChI=1S/C17H15N3O4S/c1-23-14-9-7-12(8-10-14)18-15(21)11-25-16-17(22)24-19-20(16)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H-,18,19,21,22) | COc1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251204 | 357.384 | C17 H15 N3 O4 S | APEZFUOIJWKIOQ-UHFFFAOYSA-N | InChI=1S/C17H15N3O4S/c1-23-14-9-7-13(8-10-14)20-16(17(22)24-19-20)25-11-15(21)18-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H-,18,19,21,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccccc3 | |
| AKOS005250131 | 341.318 | C17 H15 N3 O5 | OMGMYBQPUVCPCT-UHFFFAOYSA-N | InChI=1S/C17H15N3O5/c1-23-12-9-7-11(8-10-12)20-15(17(22)25-19-20)16(21)18-13-5-3-4-6-14(13)24-2/h3-10H,1-2H3,(H-,18,19,21,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccccc3OC | |
| AKOS005250132 | 341.318 | C17 H15 N3 O5 | CCJJTSMAEPMQMH-UHFFFAOYSA-N | InChI=1S/C17H15N3O5/c1-23-13-8-6-12(7-9-13)20-15(17(22)25-19-20)16(21)18-11-4-3-5-14(10-11)24-2/h3-10H,1-2H3,(H-,18,19,21,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3cccc(c3)OC | |
| AKOS005250133 | 341.318 | C17 H15 N3 O5 | KEOAHMUSACOURX-UHFFFAOYSA-N | InChI=1S/C17H15N3O5/c1-23-13-7-3-11(4-8-13)18-16(21)15-17(22)25-19-20(15)12-5-9-14(24-2)10-6-12/h3-10H,1-2H3,(H-,18,19,21,22) | COc1ccc(cc1)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005219483 | 385.397 | C17 H15 N5 O4 S | IUNWLGGMZNGBJX-UHFFFAOYSA-N | InChI=1S/C17H15N5O4S/c1-9(2)22-12(8-11-14(24)19-17(27)20-15(11)25)16(26-21-22)18-13(23)10-6-4-3-5-7-10/h3-9H,1-2H3,(H2-,18,19,20,21,23,24,25,27) | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)/C=C\3/C(=O)NC(=NC3=O)S | |
| AKOS005214338 | 329.781 | C17 H16 Cl N3 O2 | CFQRLCYETGGAES-UHFFFAOYSA-N | InChI=1S/C17H16ClN3O2/c18-14-6-4-5-13(11-14)9-10-19-12-16-17(22)23-20-21(16)15-7-2-1-3-8-15/h1-8,11,19H,9-10,12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3cccc(c3)Cl | |
| AKOS005214781 | 329.781 | C17 H16 Cl N3 O2 | LFMVBMJIYDWSOT-UHFFFAOYSA-N | InChI=1S/C17H16ClN3O2/c18-15-9-5-4-6-13(15)10-11-19-12-16-17(22)23-20-21(16)14-7-2-1-3-8-14/h1-9,19H,10-12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccccc3Cl | |
| AKOS005214790 | 329.781 | C17 H16 Cl N3 O2 | YEDSKPBDANYBCP-UHFFFAOYSA-N | InChI=1S/C17H16ClN3O2/c18-14-8-6-13(7-9-14)10-11-19-12-16-17(22)23-20-21(16)15-4-2-1-3-5-15/h1-9,19H,10-12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccc(cc3)Cl | |
| AKOS005214844 | 329.781 | C17 H16 Cl N3 O2 | RILAFCFPIXKPLN-UHFFFAOYSA-N | InChI=1S/C17H16ClN3O2/c1-12-6-8-14(9-7-12)21-16(17(22)23-20-21)11-19-10-13-4-2-3-5-15(13)18/h2-9,19H,10-11H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3ccccc3Cl | |
| AKOS005214841 | 345.78 | C17 H16 Cl N3 O3 | JDNJIKIGAGZFGV-UHFFFAOYSA-N | InChI=1S/C17H16ClN3O3/c1-23-14-8-6-13(7-9-14)21-16(17(22)24-20-21)11-19-10-12-4-2-3-5-15(12)18/h2-9,19H,10-11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3ccccc3Cl | |
| AKOS005253389 | 437.924 | C17 H16 Cl N5 O3 S2 | LHGFKKQYCIVIBT-UHFFFAOYSA-N | InChI=1S/C17H16ClN5O3S2/c18-13-3-1-12(2-4-13)14-10-27-17(19-14)28-11-15(24)20-16-9-23(21-26-16)22-5-7-25-8-6-22/h1-4,9-10H,5-8,11H2 | c1cc(ccc1c2csc(n2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)Cl | |
| AKOS005214779 | 313.326 | C17 H16 F N3 O2 | SHZJDEYALAYJKV-UHFFFAOYSA-N | InChI=1S/C17H16FN3O2/c18-14-8-6-13(7-9-14)10-11-19-12-16-17(22)23-20-21(16)15-4-2-1-3-5-15/h1-9,19H,10-12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccc(cc3)F | |
| AKOS005214780 | 313.326 | C17 H16 F N3 O2 | DNAVMJRXUZPEEL-UHFFFAOYSA-N | InChI=1S/C17H16FN3O2/c18-15-9-5-4-6-13(15)10-11-19-12-16-17(22)23-20-21(16)14-7-2-1-3-8-14/h1-9,19H,10-12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccccc3F | |
| AKOS005214856 | 313.326 | C17 H16 F N3 O2 | OOUSCYPHKZZDBG-UHFFFAOYSA-N | InChI=1S/C17H16FN3O2/c1-12-2-8-15(9-3-12)21-16(17(22)23-20-21)11-19-10-13-4-6-14(18)7-5-13/h2-9,19H,10-11H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3ccc(cc3)F | |
| AKOS005214853 | 329.326 | C17 H16 F N3 O3 | GKBYCDSCCKHNSQ-UHFFFAOYSA-N | InChI=1S/C17H16FN3O3/c1-23-15-8-6-14(7-9-15)21-16(17(22)24-20-21)11-19-10-12-2-4-13(18)5-3-12/h2-9,19H,10-11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3ccc(cc3)F | |
| AKOS005253465 | 459.4 | C17 H16 F3 N5 O5 S | LJHGHYHXVORRPN-UHFFFAOYSA-N | InChI=1S/C17H16F3N5O5S/c1-23-14(27)11(25(16(23)31)8-12-15(28)30-22-24(12)2)7-13(26)21-9-3-5-10(6-4-9)29-17(18,19)20/h3-6,11H,7-8H2,1-2H3,(H-,21,22,26,28) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C)CC(=O)Nc3ccc(cc3)OC(F)(F)F | |
| AKOS005219867 | 340.4 | C17 H16 N4 O2 S | FQIZGXOPQJGRSF-UHFFFAOYSA-N | InChI=1S/C17H16N4O2S/c1-20(17(24)18-13-8-4-2-5-9-13)12-15-16(22)23-19-21(15)14-10-6-3-7-11-14/h2-11H,12H2,1H3,(H-,18,19,22,24) | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=S)Nc3ccccc3 | |
| AKOS005250406 | 372.398 | C17 H16 N4 O4 S | QSRBOXMJLPSYHF-UHFFFAOYSA-N | InChI=1S/C17H16N4O4S/c1-10-8-11(2)19-17(18-10)26-9-14(22)15-16(23)25-20-21(15)12-4-6-13(24-3)7-5-12/h4-8H,9H2,1-3H3 | Cc1cc(nc(n1)SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005251887 | 420.463 | C17 H16 N4 O5 S2 | BOJIVMZKYOMXQM-UHFFFAOYSA-N | InChI=1S/C17H16N4O5S2/c1-11(15(22)19-12-7-9-14(10-8-12)28(18,24)25)27-16-17(23)26-20-21(16)13-5-3-2-4-6-13/h2-11H,1H3,(H3-,18,19,20,22,23,24,25) | CC(C(=O)Nc1ccc(cc1)S(=O)(=O)N)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252152 | 420.463 | C17 H16 N4 O5 S2 | JFWZAGDSKLMLRQ-UHFFFAOYSA-N | InChI=1S/C17H16N4O5S2/c18-28(24,25)14-8-6-12(7-9-14)19-15(22)10-11-27-16-17(23)26-20-21(16)13-4-2-1-3-5-13/h1-9H,10-11H2,(H3-,18,19,20,22,23,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)S(=O)(=O)N | |
| AKOS005251558 | 436.462 | C17 H16 N4 O6 S2 | DAOOMCGQKQSRNJ-UHFFFAOYSA-N | InChI=1S/C17H16N4O6S2/c1-26-13-6-4-12(5-7-13)21-16(17(23)27-20-21)28-10-15(22)19-11-2-8-14(9-3-11)29(18,24)25/h2-9H,10H2,1H3,(H3-,18,19,20,22,23,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)S(=O)(=O)N | |
| AKOS005250487 | 352.347 | C17 H16 N6 O3 | JKZPXIOUYJQQBH-UHFFFAOYSA-N | InChI=1S/C17H16N6O3/c24-15(14-16(25)26-20-23(14)13-5-2-1-3-6-13)21-9-11-22(12-10-21)17-18-7-4-8-19-17/h1-8H,9-12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)c4ncccn4 | |
| AKOS005219457 | 400.412 | C17 H16 N6 O4 S | FHZKQTDSLQSFJT-UHFFFAOYSA-N | InChI=1S/C17H16N6O4S/c1-10(2)23-7-16(27-22-23)20-15(24)8-28-17-19-12(6-18-21-17)11-3-4-13-14(5-11)26-9-25-13/h3-7,10H,8-9H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nc(cnn2)c3ccc4c(c3)OCO4 | |
| AKOS005253035 | 412.426 | C17 H16 N8 O3 S | XPWSSYZVVVPWTG-UHFFFAOYSA-N | InChI=1S/C17H16N8O3S/c26-13(19-14-9-25(23-28-14)24-5-7-27-8-6-24)10-29-17-20-16-15(21-22-17)11-3-1-2-4-12(11)18-16/h1-4,9H,5-8,10H2,(H-,18,19,20,21,22,23,26) | c1ccc2c(c1)c3c([nH]2)nc(nn3)SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005251318 | 421.245 | C17 H17 Br N4 O4 | QGMAXTISAZTQEZ-UHFFFAOYSA-N | InChI=1S/C17H17BrN4O4/c1-20-14(17(25)26-19-20)9-21(11-6-7-11)13-8-15(23)22(16(13)24)12-4-2-10(18)3-5-12/h2-5,11,13H,6-9H2,1H3 | C[n+]1c(c(on1)[O-])CN(C2CC2)C3CC(=O)N(C3=O)c4ccc(cc4)Br | |
| AKOS005251312 | 376.794 | C17 H17 Cl N4 O4 | JAVCYKAMZCBBJB-UHFFFAOYSA-N | InChI=1S/C17H17ClN4O4/c1-20-14(17(25)26-19-20)9-21(11-6-7-11)13-8-15(23)22(16(13)24)12-4-2-10(18)3-5-12/h2-5,11,13H,6-9H2,1H3 | C[n+]1c(c(on1)[O-])CN(C2CC2)C3CC(=O)N(C3=O)c4ccc(cc4)Cl | |
| AKOS005251313 | 360.34 | C17 H17 F N4 O4 | UEPXPUJYXIDBIB-UHFFFAOYSA-N | InChI=1S/C17H17FN4O4/c1-20-14(17(25)26-19-20)9-21(11-6-7-11)13-8-15(23)22(16(13)24)12-4-2-10(18)3-5-12/h2-5,11,13H,6-9H2,1H3 | C[n+]1c(c(on1)[O-])CN(C2CC2)C3CC(=O)N(C3=O)c4ccc(cc4)F | |
| AKOS005250350 | 414.336 | C17 H17 F3 N4 O5 | FSJNOFZOSYTVFI-UHFFFAOYSA-N | InChI=1S/C17H17F3N4O5/c1-23-12(16(27)29-22-23)9-24-6-7-28-13(15(24)26)8-14(25)21-11-4-2-10(3-5-11)17(18,19)20/h2-5,13H,6-9H2,1H3,(H-,21,22,25,27) | C[n+]1c(c(on1)[O-])CN2CCOC(C2=O)CC(=O)Nc3ccc(cc3)C(F)(F)F | |
| AKOS005219797 | 430.335 | C17 H17 F3 N4 O6 | VNRIDGBVRQPNER-UHFFFAOYSA-N | InChI=1S/C17H17F3N4O6/c1-23-12(16(27)30-22-23)9-24-6-7-28-13(15(24)26)8-14(25)21-10-2-4-11(5-3-10)29-17(18,19)20/h2-5,13H,6-9H2,1H3,(H-,21,22,25,27) | C[n+]1c(c(on1)[O-])CN2CCOC(C2=O)CC(=O)Nc3ccc(cc3)OC(F)(F)F | |
| AKOS005253075 | 426.416 | C17 H17 F3 N6 O2 S | KRBAGEMZDOZKHP-UHFFFAOYSA-N | InChI=1S/C17H17F3N6O2S/c1-11-7-13(17(18,19)20)12(8-21)16(22-11)29-10-14(27)23-15-9-26(24-28-15)25-5-3-2-4-6-25/h7,9H,2-6,10H2,1H3 | Cc1cc(c(c(n1)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3)C#N)C(F)(F)F | |
| AKOS005253076 | 426.416 | C17 H17 F3 N6 O2 S | NAGRMSNORXPSQI-UHFFFAOYSA-N | InChI=1S/C17H17F3N6O2S/c1-11-7-13(17(18,19)20)22-16(12(11)8-21)29-10-14(27)23-15-9-26(24-28-15)25-5-3-2-4-6-25/h7,9H,2-6,10H2,1H3 | Cc1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3)C(F)(F)F | |
| AKOS005214171 | 295.336 | C17 H17 N3 O2 | VSEQBHUTRUITMW-UHFFFAOYSA-N | InChI=1S/C17H17N3O2/c1-13(14-8-4-2-5-9-14)18-12-16-17(21)22-19-20(16)15-10-6-3-7-11-15/h2-11,13,18H,12H2,1H3 | CC(c1ccccc1)NCc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005214181 | 295.336 | C17 H17 N3 O2 | KYLYTUXYFIYKAF-UHFFFAOYSA-N | InChI=1S/C17H17N3O2/c1-13-7-9-14(10-8-13)11-18-12-16-17(21)22-19-20(16)15-5-3-2-4-6-15/h2-10,18H,11-12H2,1H3 | Cc1ccc(cc1)CNCc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005214182 | 295.336 | C17 H17 N3 O2 | IOHJDHHOHNQJRT-UHFFFAOYSA-N | InChI=1S/C17H17N3O2/c21-17-16(13-18-12-11-14-7-3-1-4-8-14)20(19-22-17)15-9-5-2-6-10-15/h1-10,18H,11-13H2 | c1ccc(cc1)CCNCc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005214724 | 295.336 | C17 H17 N3 O2 | NBFIWSLHONTDAT-UHFFFAOYSA-N | InChI=1S/C17H17N3O2/c1-13-7-9-15(10-8-13)20-16(17(21)22-19-20)12-18-11-14-5-3-2-4-6-14/h2-10,18H,11-12H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3ccccc3 | |
| AKOS005214722 | 311.335 | C17 H17 N3 O3 | KPLLICFCRKBWKU-UHFFFAOYSA-N | InChI=1S/C17H17N3O3/c1-22-15-9-7-14(8-10-15)20-16(17(21)23-19-20)12-18-11-13-5-3-2-4-6-13/h2-10,18H,11-12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3ccccc3 | |
| AKOS005252092 | 343.4 | C17 H17 N3 O3 S | UGSYVNOCIUKEMP-UHFFFAOYSA-N | InChI=1S/C17H17N3O3S/c1-3-14(24-16-17(22)23-19-20(16)2)15(21)18-13-9-8-11-6-4-5-7-12(11)10-13/h4-10,14H,3H2,1-2H3,(H-,18,19,21,22) | CCC(C(=O)Nc1ccc2ccccc2c1)Sc3c(on[n+]3C)[O-] | |
| AKOS005252107 | 343.4 | C17 H17 N3 O3 S | NMHOZGXQIPACRT-UHFFFAOYSA-N | InChI=1S/C17H17N3O3S/c1-3-14(24-16-17(22)23-19-20(16)2)15(21)18-13-10-6-8-11-7-4-5-9-12(11)13/h4-10,14H,3H2,1-2H3,(H-,18,19,21,22) | CCC(C(=O)Nc1cccc2c1cccc2)Sc3c(on[n+]3C)[O-] | |
| AKOS005250780 | 359.4 | C17 H17 N3 O4 S | ZHQJBCPHXAXOPJ-UHFFFAOYSA-N | InChI=1S/C17H17N3O4S/c1-23-13-6-4-12(5-7-13)20-16(17(22)24-19-20)15(21)10-25-14-8-2-11(18)3-9-14/h2,4-8H,3,9-10,18H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=CC=C(CC3)N | |
| AKOS005252820 | 371.414 | C17 H17 N5 O3 S | ZUCHDKRPYMEGBY-UHFFFAOYSA-N | InChI=1S/C17H17N5O3S/c1-2-21-9-15(25-20-21)19-14(23)10-26-17-18-13-6-4-3-5-12(13)16(24)22(17)11-7-8-11/h3-6,9,11H,2,7-8,10H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3c(=O)n2C4CC4 | |
| AKOS005253015 | 403.479 | C17 H17 N5 O3 S2 | BETVLRHYWOUVNB-UHFFFAOYSA-N | InChI=1S/C17H17N5O3S2/c23-15(19-16-10-22(20-25-16)21-6-8-24-9-7-21)12-27-17-18-14(11-26-17)13-4-2-1-3-5-13/h1-5,10-11H,6-9,12H2 | c1ccc(cc1)c2csc(n2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4 | |
| AKOS005251355 | 387.347 | C17 H17 N5 O6 | VHSJQAHAQJMLOT-UHFFFAOYSA-N | InChI=1S/C17H17N5O6/c1-19-14(17(25)28-18-19)9-20(10-2-3-10)13-8-15(23)21(16(13)24)11-4-6-12(7-5-11)22(26)27/h4-7,10,13H,2-3,8-9H2,1H3 | C[n+]1c(c(on1)[O-])CN(C2CC2)C3CC(=O)N(C3=O)c4ccc(cc4)[N+](=O)[O-] | |
| AKOS005252904 | 383.428 | C17 H17 N7 O2 S | XIZGMPWLRYIQBU-UHFFFAOYSA-N | InChI=1S/C17H17N7O2S/c1-9(2)24-7-14(26-23-24)21-13(25)8-27-17-12(6-19)15(10-3-4-10)11(5-18)16(20)22-17/h7,9-10H,3-4,8H2,1-2H3,(H2-,20,21,22,23,25) | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)C3CC3)C#N | |
| AKOS005253342 | 399.427 | C17 H17 N7 O3 S | YJZGVKQKBFWTKT-UHFFFAOYSA-N | InChI=1S/C17H17N7O3S/c1-26-5-4-24-8-14(27-23-24)21-13(25)9-28-17-12(7-19)15(10-2-3-10)11(6-18)16(20)22-17/h8,10H,2-5,9H2,1H3,(H2-,20,21,22,23,25) | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)C3CC3)C#N | |
| AKOS005253508 | 468.325 | C17 H18 Br N5 O4 S | WITJOJAFSGQXHJ-UHFFFAOYSA-N | InChI=1S/C17H18BrN5O4S/c1-3-22-15(25)12(8-14(24)19-11-6-4-10(18)5-7-11)23(17(22)28)9-13-16(26)27-20-21(13)2/h4-7,12H,3,8-9H2,1-2H3,(H-,19,20,24,26) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)Br | |
| AKOS005253507 | 423.874 | C17 H18 Cl N5 O4 S | FORPPNXLRWIOOS-UHFFFAOYSA-N | InChI=1S/C17H18ClN5O4S/c1-3-22-15(25)12(8-14(24)19-11-6-4-10(18)5-7-11)23(17(22)28)9-13-16(26)27-20-21(13)2/h4-7,12H,3,8-9H2,1-2H3,(H-,19,20,24,26) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)Cl | |
| AKOS005253516 | 407.419 | C17 H18 F N5 O4 S | JQYULQKXCZDQEL-UHFFFAOYSA-N | InChI=1S/C17H18FN5O4S/c1-3-22-15(25)12(8-14(24)19-11-6-4-10(18)5-7-11)23(17(22)28)9-13-16(26)27-20-21(13)2/h4-7,12H,3,8-9H2,1-2H3,(H-,19,20,24,26) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)F | |
| AKOS005253515 | 515.325 | C17 H18 I N5 O4 S | IEVJQIHGXHFCPV-UHFFFAOYSA-N | InChI=1S/C17H18IN5O4S/c1-3-22-15(25)12(8-14(24)19-11-6-4-10(18)5-7-11)23(17(22)28)9-13-16(26)27-20-21(13)2/h4-7,12H,3,8-9H2,1-2H3,(H-,19,20,24,26) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)I | |
| AKOS005219476 | 359.316 | C17 H18 N3 O4 P | ULVQJHFIJZKMNX-UHFFFAOYSA-N | InChI=1S/C17H18N3O4P/c1-14(2)20-13-17(22-19-20)18-25(21,23-15-9-5-3-6-10-15)24-16-11-7-4-8-12-16/h3-14H,1-2H3 | CC(C)[n+]1cc(on1)[N-]P(=O)(Oc2ccccc2)Oc3ccccc3 | |
| AKOS005252671 | 374.48 | C17 H18 N4 O2 S2 | OURFCVRVWHOWJQ-UHFFFAOYSA-N | InChI=1S/C17H18N4O2S2/c1-11(2)21-8-16(23-20-21)19-15(22)10-25-17-18-14(9-24-17)13-6-4-12(3)5-7-13/h4-9,11H,10H2,1-3H3 | Cc1ccc(cc1)c2csc(n2)SCC(=O)[N-]c3c[n+](no3)C(C)C | |
| AKOS005219532 | 358.415 | C17 H18 N4 O3 S | UUAGBQYEHNPKFS-UHFFFAOYSA-N | InChI=1S/C17H18N4O3S/c1-21-15(17(23)24-20-21)14(22)10-25-16-12(9-18)8-11-6-4-2-3-5-7-13(11)19-16/h8H,2-7,10H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2c(cc3c(n2)CCCCCC3)C#N | |
| AKOS005253847 | 358.415 | C17 H18 N4 O3 S | KNSWOQIFILVUGO-UHFFFAOYSA-N | InChI=1S/C17H18N4O3S/c1-21-13(17(23)24-20-21)14(22)15-12(18)10-8-9-6-4-2-3-5-7-11(9)19-16(10)25-15/h8H,2-7H2,1H3,(H2-,18,20,22,23) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3cc4c(nc3s2)CCCCCC4)N | |
| AKOS005252779 | 390.48 | C17 H18 N4 O3 S2 | MIWWPOYNRFAHLQ-UHFFFAOYSA-N | InChI=1S/C17H18N4O3S2/c1-11(2)21-8-16(24-20-21)19-15(22)10-26-17-18-14(9-25-17)12-4-6-13(23-3)7-5-12/h4-9,11H,10H2,1-3H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nc(cs2)c3ccc(cc3)OC | |
| AKOS005253384 | 390.48 | C17 H18 N4 O3 S2 | ANGOLGQRGTWART-UHFFFAOYSA-N | InChI=1S/C17H18N4O3S2/c1-12-3-5-13(6-4-12)14-10-25-17(18-14)26-11-15(22)19-16-9-21(20-24-16)7-8-23-2/h3-6,9-10H,7-8,11H2,1-2H3 | Cc1ccc(cc1)c2csc(n2)SCC(=O)[N-]c3c[n+](no3)CCOC | |
| AKOS005250909 | 342.349 | C17 H18 N4 O4 | GJUDYNKFFLPCKV-UHFFFAOYSA-O | InChI=1S/C17H17N4O4/c1-20-14(17(24)25-19-20)11-13(16(23)21-9-5-6-10-21)18-15(22)12-7-3-2-4-8-12/h2-4,7-8,11H,5-6,9-10H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCCC2)\NC(=O)c3ccccc3 | |
| AKOS005251303 | 342.349 | C17 H18 N4 O4 | GPKRHIZGPMHRDE-UHFFFAOYSA-N | InChI=1S/C17H18N4O4/c1-19-14(17(24)25-18-19)10-20(11-7-8-11)13-9-15(22)21(16(13)23)12-5-3-2-4-6-12/h2-6,11,13H,7-10H2,1H3 | C[n+]1c(c(on1)[O-])CN(C2CC2)C3CC(=O)N(C3=O)c4ccccc4 | |
| AKOS005214770 | 374.414 | C17 H18 N4 O4 S | OWHUWTHURQXPHK-UHFFFAOYSA-N | InChI=1S/C17H18N4O4S/c18-26(23,24)15-8-6-13(7-9-15)10-11-19-12-16-17(22)25-20-21(16)14-4-2-1-3-5-14/h1-9,19H,10-12H2,(H2-,18,20,22,23,24) | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccc(cc3)S(=O)(=O)N | |
| AKOS005250925 | 374.414 | C17 H18 N4 O4 S | LZPDAWHJUMKBIO-UHFFFAOYSA-O | InChI=1S/C17H17N4O4S/c1-20-14(17(24)25-19-20)11-13(16(23)21-7-9-26-10-8-21)18-15(22)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCSCC2)\NC(=O)c3ccccc3 | |
| AKOS005253314 | 406.479 | C17 H18 N4 O4 S2 | OCGFOBGCMUNBQG-UHFFFAOYSA-N | InChI=1S/C17H18N4O4S2/c1-23-8-7-21-9-16(25-20-21)19-15(22)11-27-17-18-14(10-26-17)12-3-5-13(24-2)6-4-12/h3-6,9-10H,7-8,11H2,1-2H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2nc(cs2)c3ccc(cc3)OC | |
| AKOS005250917 | 358.349 | C17 H18 N4 O5 | RNXWDENEYMULQS-UHFFFAOYSA-O | InChI=1S/C17H17N4O5/c1-20-14(17(24)26-19-20)11-13(16(23)21-7-9-25-10-8-21)18-15(22)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCOCC2)\NC(=O)c3ccccc3 | |
| AKOS005251287 | 358.349 | C17 H18 N4 O5 | ZZPVPFRUFZSRPJ-UHFFFAOYSA-N | InChI=1S/C17H18N4O5/c1-10(22)11-4-6-12(7-5-11)21-15(23)8-13(16(21)24)19(2)9-14-17(25)26-18-20(14)3/h4-7,13H,8-9H2,1-3H3 | CC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)N(C)Cc3c(on[n+]3C)[O-] | |
| AKOS005253369 | 374.348 | C17 H18 N4 O6 | YOONXXYROGYRFL-UHFFFAOYSA-N | InChI=1S/C17H18N4O6/c1-3-26-16(24)10-4-6-11(7-5-10)21-14(22)8-12(15(21)23)18-9-13-17(25)27-19-20(13)2/h4-7,12,18H,3,8-9H2,1-2H3 | CCOC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)NCc3c(on[n+]3C)[O-] | |
| AKOS005253028 | 386.428 | C17 H18 N6 O3 S | KJAYPGNRLLTILJ-UHFFFAOYSA-N | InChI=1S/C17H18N6O3S/c18-9-13-8-12-2-1-3-14(12)19-17(13)27-11-15(24)20-16-10-23(21-26-16)22-4-6-25-7-5-22/h8,10H,1-7,11H2 | c1c2c(nc(c1C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)CCC2 | |
| AKOS005253135 | 386.428 | C17 H18 N6 O3 S | YXOWMSSFVPTJQZ-UHFFFAOYSA-N | InChI=1S/C17H18N6O3S/c1-21(2)22-9-15(26-20-22)19-14(24)10-27-17-18-13-6-4-3-5-12(13)16(25)23(17)11-7-8-11/h3-6,9,11H,7-8,10H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3c(=O)n2C4CC4 | |
| AKOS005253026 | 402.428 | C17 H18 N6 O4 S | OHENLTMHIKFFLH-UHFFFAOYSA-N | InChI=1S/C17H18N6O4S/c1-21-16(25)12-4-2-3-5-13(12)18-17(21)28-11-14(24)19-15-10-23(20-27-15)22-6-8-26-9-7-22/h2-5,10H,6-9,11H2,1H3 | Cn1c(=O)c2ccccc2nc1SCC(=O)[N-]c3c[n+](no3)N4CCOCC4 | |
| AKOS005253474 | 418.427 | C17 H18 N6 O5 S | UQRRHOCBGOUFDB-UHFFFAOYSA-N | InChI=1S/C17H18N6O5S/c1-21-15(26)11(23(17(21)29)8-12-16(27)28-20-22(12)2)7-13(24)19-10-5-3-9(4-6-10)14(18)25/h3-6,11H,7-8H2,1-2H3,(H3-,18,19,20,24,25,27) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C)CC(=O)Nc3ccc(cc3)C(=O)N | |
| AKOS005253468 | 434.426 | C17 H18 N6 O6 S | CTCYXBHKBGCISK-UHFFFAOYSA-N | InChI=1S/C17H18N6O6S/c1-3-21-15(25)12(22(17(21)30)9-13-16(26)29-19-20(13)2)8-14(24)18-10-4-6-11(7-5-10)23(27)28/h4-7,12H,3,8-9H2,1-2H3,(H-,18,19,24,26) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)N(=O)=O | |
| AKOS005250332 | 313.351 | C17 H19 N3 O3 | FLTCAGJAXWXXIB-UHFFFAOYSA-N | InChI=1S/C17H19N3O3/c21-16(12-5-4-6-12)19(13-9-10-13)11-15-17(22)23-18-20(15)14-7-2-1-3-8-14/h1-3,7-8,12-13H,4-6,9-11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)C4CCC4 | |
| AKOS005219564 | 377.481 | C17 H19 N3 O3 S2 | TWWODVOJNGCSPQ-UHFFFAOYSA-N | InChI=1S/C17H19N3O3S2/c1-12-7-5-6-10-19(12)17(24)25-11-14(21)15-16(22)23-18-20(15)13-8-3-2-4-9-13/h2-4,8-9,12H,5-7,10-11H2,1H3 | CC1CCCCN1C(=S)SCC(=O)c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250280 | 329.35 | C17 H19 N3 O4 | CXESAWMMJUHOSD-UHFFFAOYSA-N | InChI=1S/C17H19N3O4/c1-23-14-8-6-13(7-9-14)20-15(17(22)24-18-20)10-19(12-4-5-12)16(21)11-2-3-11/h6-9,11-12H,2-5,10H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)C4CC4 | |
| AKOS005251349 | 393.48 | C17 H19 N3 O4 S2 | OFCNDFCPJQPUET-UHFFFAOYSA-N | InChI=1S/C17H19N3O4S2/c1-23-13-7-5-12(6-8-13)20-15(16(22)24-18-20)14(21)11-26-17(25)19-9-3-2-4-10-19/h5-8H,2-4,9-11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC(=S)N3CCCCC3 | |
| AKOS005250483 | 345.35 | C17 H19 N3 O5 | OYCTYKBBLLEVCR-UHFFFAOYSA-N | InChI=1S/C17H19N3O5/c1-2-24-16(22)12-8-10-19(11-9-12)15(21)14-17(23)25-18-20(14)13-6-4-3-5-7-13/h3-7,12H,2,8-11H2,1H3 | CCOC(=O)C1CCN(CC1)C(=O)c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250490 | 345.35 | C17 H19 N3 O5 | MSKJBPVVNVGGEN-UHFFFAOYSA-N | InChI=1S/C17H19N3O5/c1-2-24-16(22)12-7-6-10-19(11-12)15(21)14-17(23)25-18-20(14)13-8-4-3-5-9-13/h3-5,8-9,12H,2,6-7,10-11H2,1H3 | CCOC(=O)C1CCCN(C1)C(=O)c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252408 | 357.43 | C17 H19 N5 O2 S | CXYOWRLDJBNUAH-UHFFFAOYSA-N | InChI=1S/C17H19N5O2S/c1-22-10-16(24-21-22)20-15(23)11-25-17-13(9-18)8-12-6-4-2-3-5-7-14(12)19-17/h8,10H,2-7,11H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCCCCC3)C#N | |
| AKOS005252491 | 357.43 | C17 H19 N5 O2 S | LYMNFXXJVXVWGR-UHFFFAOYSA-N | InChI=1S/C17H19N5O2S/c1-2-22-10-16(24-21-22)20-15(23)11-25-17-13(9-18)8-12-6-4-3-5-7-14(12)19-17/h8,10H,2-7,11H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCCCC3)C#N | |
| AKOS005252500 | 357.43 | C17 H19 N5 O2 S | REUIOAUOMKGUNJ-UHFFFAOYSA-N | InChI=1S/C17H19N5O2S/c1-3-22-9-16(24-21-22)20-15(23)10-25-17-13(8-18)7-12-6-11(2)4-5-14(12)19-17/h7,9,11H,3-6,10H2,1-2H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCC(C3)C)C#N | |
| AKOS005252835 | 357.43 | C17 H19 N5 O2 S | XHOJCUAMOKBXPA-UHFFFAOYSA-N | InChI=1S/C17H19N5O2S/c1-11(2)22-9-16(24-21-22)20-15(23)10-25-17-13(8-18)7-12-5-3-4-6-14(12)19-17/h7,9,11H,3-6,10H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCCC3)C#N | |
| AKOS005252876 | 373.429 | C17 H19 N5 O3 S | VNNVAGYCXPIPET-UHFFFAOYSA-N | InChI=1S/C17H19N5O3S/c1-4-21-16(24)12-7-5-6-8-13(12)18-17(21)26-10-14(23)19-15-9-22(11(2)3)20-25-15/h5-9,11H,4,10H2,1-3H3 | CCn1c(=O)c2ccccc2nc1SCC(=O)[N-]c3c[n+](no3)C(C)C | |
| AKOS005253415 | 373.429 | C17 H19 N5 O3 S | VETTYNKHRZDYSX-UHFFFAOYSA-N | InChI=1S/C17H19N5O3S/c1-24-7-6-22-10-16(25-21-22)20-15(23)11-26-17-13(9-18)8-12-4-2-3-5-14(12)19-17/h8,10H,2-7,11H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCCC3)C#N | |
| AKOS005252900 | 389.429 | C17 H19 N5 O4 S | NWARYVVKOMUQPF-UHFFFAOYSA-N | InChI=1S/C17H19N5O4S/c1-5-25-17(24)12-6-11(4)19-16(13(12)7-18)27-9-14(23)20-15-8-22(10(2)3)21-26-15/h6,8,10H,5,9H2,1-4H3 | CCOC(=O)c1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)C(C)C)C | |
| AKOS005253413 | 389.429 | C17 H19 N5 O4 S | OKZUJSRARCAGRD-UHFFFAOYSA-N | InChI=1S/C17H19N5O4S/c1-3-22-16(24)12-6-4-5-7-13(12)18-17(22)27-11-14(23)19-15-10-21(20-26-15)8-9-25-2/h4-7,10H,3,8-9,11H2,1-2H3 | CCn1c(=O)c2ccccc2nc1SCC(=O)[N-]c3c[n+](no3)CCOC | |
| AKOS005253451 | 389.429 | C17 H19 N5 O4 S | YYTSFAZNCBCFQO-UHFFFAOYSA-N | InChI=1S/C17H19N5O4S/c1-3-21-15(24)12(9-14(23)18-11-7-5-4-6-8-11)22(17(21)27)10-13-16(25)26-19-20(13)2/h4-8,12H,3,9-10H2,1-2H3,(H-,18,19,23,25) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccccc3 | |
| AKOS005253457 | 389.429 | C17 H19 N5 O4 S | PHOIZNHTMFRREL-UHFFFAOYSA-N | InChI=1S/C17H19N5O4S/c1-10-4-6-11(7-5-10)18-14(23)8-12-15(24)20(2)17(27)22(12)9-13-16(25)26-19-21(13)3/h4-7,12H,8-9H2,1-3H3,(H-,18,19,23,25) | Cc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])C | |
| AKOS005251938 | 421.494 | C17 H19 N5 O4 S2 | ILUIPONUWAPEOO-UHFFFAOYSA-N | InChI=1S/C17H19N5O4S2/c1-4-12(28-16-17(25)26-20-21(16)3)14(24)19-15-11(7-18)10-5-6-22(9(2)23)8-13(10)27-15/h12H,4-6,8H2,1-3H3,(H-,19,20,24,25) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)C)C#N)Sc3c(on[n+]3C)[O-] | |
| AKOS005251305 | 373.363 | C17 H19 N5 O5 | NXPFHMWFUJWPES-UHFFFAOYSA-N | InChI=1S/C17H19N5O5/c1-10(23)18-11-4-6-12(7-5-11)22-15(24)8-13(16(22)25)20(2)9-14-17(26)27-19-21(14)3/h4-7,13H,8-9H2,1-3H3,(H-,18,19,23,26) | CC(=O)Nc1ccc(cc1)N2C(=O)CC(C2=O)N(C)Cc3c(on[n+]3C)[O-] | |
| AKOS005251366 | 373.363 | C17 H19 N5 O5 | VWVZZBJKABLNQE-UHFFFAOYSA-O | InChI=1S/C17H18N5O5/c1-21-14(17(25)27-20-21)11-13(16(24)19-22-7-9-26-10-8-22)18-15(23)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H,19,24)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NN2CCOCC2)\NC(=O)c3ccccc3 | |
| AKOS005250607 | 405.428 | C17 H19 N5 O5 S | IVVWSVLWQHWLLI-UHFFFAOYSA-N | InChI=1S/C17H19N5O5S/c1-17(2,3)26-16(25)22-6-5-9-10(7-18)14(28-11(9)8-22)19-13(23)12-15(24)27-20-21(12)4/h5-6,8H2,1-4H3,(H-,19,20,23,24) | CC(C)(C)OC(=O)N1CCc2c(sc(c2C#N)NC(=O)c3c(on[n+]3C)[O-])C1 | |
| AKOS005253405 | 405.428 | C17 H19 N5 O5 S | IMODVOGLWCBGSV-UHFFFAOYSA-N | InChI=1S/C17H19N5O5S/c1-4-26-17(24)12-7-11(2)19-16(13(12)8-18)28-10-14(23)20-15-9-22(21-27-15)5-6-25-3/h7,9H,4-6,10H2,1-3H3 | CCOC(=O)c1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)CCOC)C | |
| AKOS005253458 | 405.428 | C17 H19 N5 O5 S | BYBRTFFBQIKEFE-UHFFFAOYSA-N | InChI=1S/C17H19N5O5S/c1-20-15(24)12(8-14(23)18-10-4-6-11(26-3)7-5-10)22(17(20)28)9-13-16(25)27-19-21(13)2/h4-7,12H,8-9H2,1-3H3,(H-,18,19,23,25) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C)CC(=O)Nc3ccc(cc3)OC | |
| AKOS005219897 | 389.363 | C17 H19 N5 O6 | SOYUHIPEBNPGNN-UHFFFAOYSA-N | InChI=1S/C17H19N5O6/c1-21-12(17(26)28-20-21)9-22-6-7-27-13(16(22)25)8-14(23)19-11-4-2-10(3-5-11)15(18)24/h2-5,13H,6-9H2,1H3,(H3-,18,19,20,23,24,26) | C[n+]1c(c(on1)[O-])CN2CCOC(C2=O)CC(=O)Nc3ccc(cc3)C(=O)N | |
| AKOS005252880 | 385.443 | C17 H19 N7 O2 S | UZHHGFCPNQVIFL-UHFFFAOYSA-N | InChI=1S/C17H19N7O2S/c1-9(2)15-11(5-18)16(20)22-17(12(15)6-19)27-8-13(25)21-14-7-24(10(3)4)23-26-14/h7,9-10H,8H2,1-4H3,(H2-,20,21,22,23,25) | CC(C)c1c(c(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)C(C)C)N)C#N | |
| AKOS005253317 | 401.443 | C17 H19 N7 O3 S | HOHMRLBVNYOWKT-UHFFFAOYSA-N | InChI=1S/C17H19N7O3S/c1-10(2)15-11(6-18)16(20)22-17(12(15)7-19)28-9-13(25)21-14-8-24(23-27-14)4-5-26-3/h8,10H,4-5,9H2,1-3H3,(H2-,20,21,22,23,25) | CC(C)c1c(c(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)CCOC)N)C#N | |
| AKOS005250407 | 348.417 | C17 H20 N2 O4 S | MOOGZIQNPRWOOV-UHFFFAOYSA-N | InChI=1S/C17H20N2O4S/c1-22-13-9-7-12(8-10-13)19-16(17(21)23-18-19)15(20)11-24-14-5-3-2-4-6-14/h7-10,14H,2-6,11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3CCCCC3 | |
| AKOS005250613 | 360.431 | C17 H20 N4 O3 S | AISBNYWVCPRWSA-UHFFFAOYSA-N | InChI=1S/C17H20N4O3S/c1-17(2,3)9-5-6-10-11(8-18)15(25-12(10)7-9)19-14(22)13-16(23)24-20-21(13)4/h9H,5-7H2,1-4H3,(H-,19,20,22,23) | CC(C)(C)C1CCc2c(sc(c2C#N)NC(=O)c3c(on[n+]3C)[O-])C1 | |
| AKOS005251944 | 392.496 | C17 H20 N4 O3 S2 | WPVCXXXMTXCOKT-UHFFFAOYSA-N | InChI=1S/C17H20N4O3S2/c1-4-12(26-16-17(23)24-20-21(16)3)14(22)19-15-11(8-18)10-6-5-9(2)7-13(10)25-15/h9,12H,4-7H2,1-3H3,(H-,19,20,22,23) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C)C#N)Sc3c(on[n+]3C)[O-] | |
| AKOS005250896 | 344.365 | C17 H20 N4 O4 | JNEQNJBESYCZCK-UHFFFAOYSA-O | InChI=1S/C17H19N4O4/c1-17(2,3)19-15(23)12(10-13-16(24)25-20-21(13)4)18-14(22)11-8-6-5-7-9-11/h5-10H,1-4H3,(H,19,23)/q-1/p+1 | CC(C)(C)NC(=O)/C(=C/c1c(on[n+]1C)[O-])/NC(=O)c2ccccc2 | |
| AKOS005250902 | 344.365 | C17 H20 N4 O4 | FCHSKSYRNWNFPG-UHFFFAOYSA-O | InChI=1S/C17H19N4O4/c1-4-21(5-2)16(23)13(11-14-17(24)25-19-20(14)3)18-15(22)12-9-7-6-8-10-12/h6-11H,4-5H2,1-3H3/q-1/p+1 | CCN(CC)C(=O)/C(=C/c1c(on[n+]1C)[O-])/NC(=O)c2ccccc2 | |
| AKOS005250962 | 344.365 | C17 H20 N4 O4 | GTPJGRIXONRVKI-UHFFFAOYSA-O | InChI=1S/C17H19N4O4/c1-4-11(2)18-16(23)13(10-14-17(24)25-20-21(14)3)19-15(22)12-8-6-5-7-9-12/h5-11H,4H2,1-3H3,(H,18,23)/q-1/p+1 | CCC(C)NC(=O)/C(=C/c1c(on[n+]1C)[O-])/NC(=O)c2ccccc2 | |
| AKOS005219872 | 360.364 | C17 H20 N4 O5 | QUXKAGUPSZOXSK-UHFFFAOYSA-N | InChI=1S/C17H20N4O5/c1-19-14(17(25)26-18-19)9-21(13-7-8-13)15(22)10-20(11-16(23)24)12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3,(H-,18,23,24,25) | C[n+]1c(c(on1)[O-])CN(C2CC2)C(=O)CN(CC(=O)O)c3ccccc3 | |
| AKOS005250092 | 360.364 | C17 H20 N4 O5 | RSGOUXFVTZECFP-UHFFFAOYSA-N | InChI=1S/C17H20N4O5/c1-11-3-5-12(6-4-11)18-15(22)9-14-16(23)21(7-8-25-14)10-13-17(24)26-19-20(13)2/h3-6,14H,7-10H2,1-2H3,(H-,18,19,22,24) | Cc1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3C)[O-] | |
| AKOS005251280 | 360.364 | C17 H20 N4 O5 | BSNTXXWQXXCGLS-UHFFFAOYSA-N | InChI=1S/C17H20N4O5/c1-4-25-12-7-5-11(6-8-12)21-15(22)9-13(16(21)23)19(2)10-14-17(24)26-18-20(14)3/h5-8,13H,4,9-10H2,1-3H3 | CCOc1ccc(cc1)N2C(=O)CC(C2=O)N(C)Cc3c(on[n+]3C)[O-] | |
| AKOS005251383 | 360.364 | C17 H20 N4 O5 | VCEMNNIRYFEHHE-UHFFFAOYSA-O | InChI=1S/C17H19N4O5/c1-21-14(17(24)26-20-21)11-13(16(23)18-9-6-10-25-2)19-15(22)12-7-4-3-5-8-12/h3-5,7-8,11H,6,9-10H2,1-2H3,(H,18,23)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCCOC)\NC(=O)c2ccccc2 | |
| AKOS005219859 | 376.364 | C17 H20 N4 O6 | XYCNPCGMHWAMNN-UHFFFAOYSA-N | InChI=1S/C17H20N4O6/c1-20-13(17(24)27-19-20)10-21-7-8-26-14(16(21)23)9-15(22)18-11-3-5-12(25-2)6-4-11/h3-6,14H,7-10H2,1-2H3,(H-,18,19,22,24) | C[n+]1c(c(on1)[O-])CN2CCOC(C2=O)CC(=O)Nc3ccc(cc3)OC | |
| AKOS005250572 | 376.364 | C17 H20 N4 O6 | PWFMKQHDDFGHNX-UHFFFAOYSA-N | InChI=1S/C17H20N4O6/c1-3-26-17(24)20-10-8-19(9-11-20)15(22)14-16(23)27-18-21(14)12-4-6-13(25-2)7-5-12/h4-7H,3,8-11H2,1-2H3 | CCOC(=O)N1CCN(CC1)C(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250954 | 376.364 | C17 H20 N4 O6 | SBABCQYDILSFGA-UHFFFAOYSA-O | InChI=1S/C17H19N4O6/c1-21-13(17(24)27-20-21)9-12(16(23)18-10-14(25-2)26-3)19-15(22)11-7-5-4-6-8-11/h4-9,14H,10H2,1-3H3,(H,18,23)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCC(OC)OC)\NC(=O)c2ccccc2 | |
| AKOS005251570 | 440.494 | C17 H20 N4 O6 S2 | HNJSJZAJXRNKGA-UHFFFAOYSA-N | InChI=1S/C17H20N4O6S2/c1-4-26-16(24)13-10-5-6-21(9(2)22)7-11(10)29-14(13)18-12(23)8-28-15-17(25)27-19-20(15)3/h4-8H2,1-3H3,(H-,18,19,23,24,25) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3C)[O-])CN(CC2)C(=O)C | |
| AKOS005251760 | 440.494 | C17 H20 N4 O6 S2 | MBVQAGDWNHOAKD-UHFFFAOYSA-N | InChI=1S/C17H20N4O6S2/c1-8(28-15-17(25)27-19-20(15)3)13(23)18-14-12(16(24)26-4)10-5-6-21(9(2)22)7-11(10)29-14/h8H,5-7H2,1-4H3,(H-,18,19,23,24,25) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)C)C(=O)OC)Sc3c(on[n+]3C)[O-] | |
| AKOS005252647 | 440.494 | C17 H20 N4 O6 S2 | IGGMDFJCGZBNLD-UHFFFAOYSA-N | InChI=1S/C17H20N4O6S2/c1-9(22)21-6-4-10-11(8-21)29-14(13(10)16(24)26-3)18-12(23)5-7-28-15-17(25)27-19-20(15)2/h4-8H2,1-3H3,(H-,18,19,23,24,25) | CC(=O)N1CCc2c(sc(c2C(=O)OC)NC(=O)CCSc3c(on[n+]3C)[O-])C1 | |
| AKOS005253361 | 425.956 | C17 H20 N5 O2 S2 . Cl | BXOHFTKPJBPHBQ-UHFFFAOYSA-N | InChI=1S/C17H19N5O2S2.ClH/c1-10(2)22-8-15(24-21-22)20-14(23)9-25-17-12-6-4-3-5-11(12)13(7-18)16(19)26-17;/h8,10,19H,3-6,9H2,1-2H3;1H | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c3c(c(c([s+]2)N)C#N)CCCC3.[Cl-] | |
| AKOS005253315 | 441.955 | C17 H20 N5 O3 S2 . Cl | OGPSSKPQDUSUJN-UHFFFAOYSA-N | InChI=1S/C17H19N5O3S2.ClH/c1-24-7-6-22-9-15(25-21-22)20-14(23)10-26-17-12-5-3-2-4-11(12)13(8-18)16(19)27-17;/h9,19H,2-7,10H2,1H3;1H | COCC[n+]1cc(on1)[N-]C(=O)CSc2c3c(c(c([s+]2)N)C#N)CCCC3.[Cl-] | |
| AKOS005252698 | 372.445 | C17 H20 N6 O2 S | PTMRWXFEKBVCBV-UHFFFAOYSA-N | InChI=1S/C17H20N6O2S/c1-22(2)23-10-16(25-21-23)20-15(24)11-26-17-13(9-18)8-12-6-4-3-5-7-14(12)19-17/h8,10H,3-7,11H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCCCC3)C#N | |
| AKOS005252706 | 372.445 | C17 H20 N6 O2 S | FDYNDLFECZABKH-UHFFFAOYSA-N | InChI=1S/C17H20N6O2S/c1-11-4-5-14-12(6-11)7-13(8-18)17(19-14)26-10-15(24)20-16-9-23(21-25-16)22(2)3/h7,9,11H,4-6,10H2,1-3H3 | CC1CCc2c(cc(c(n2)SCC(=O)[N-]c3c[n+](no3)N(C)C)C#N)C1 | |
| AKOS005253057 | 372.445 | C17 H20 N6 O2 S | IMHALZXAYCUIHQ-UHFFFAOYSA-N | InChI=1S/C17H20N6O2S/c1-12-8-13(2)19-17(14(12)9-18)26-11-15(24)20-16-10-23(21-25-16)22-6-4-3-5-7-22/h8,10H,3-7,11H2,1-2H3 | Cc1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3)C | |
| AKOS005252944 | 388.444 | C17 H20 N6 O3 S | WXWDPPHOSKTWSQ-UHFFFAOYSA-N | InChI=1S/C17H20N6O3S/c1-11-12(2)14(8-18)17(19-13(11)3)27-10-15(24)20-16-9-23(21-26-16)22-4-6-25-7-5-22/h9H,4-7,10H2,1-3H3 | Cc1c(c(c(nc1C)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3)C#N)C | |
| AKOS005252968 | 388.444 | C17 H20 N6 O3 S | XHXOKTKQMWWVLZ-UHFFFAOYSA-N | InChI=1S/C17H20N6O3S/c1-12(2)14-4-3-13(9-18)17(19-14)27-11-15(24)20-16-10-23(21-26-16)22-5-7-25-8-6-22/h3-4,10,12H,5-8,11H2,1-2H3 | CC(C)c1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3)C#N | |
| AKOS005252975 | 388.444 | C17 H20 N6 O3 S | YWPIIZDODSFSKV-UHFFFAOYSA-N | InChI=1S/C17H20N6O3S/c1-2-3-14-5-4-13(10-18)17(19-14)27-12-15(24)20-16-11-23(21-26-16)22-6-8-25-9-7-22/h4-5,11H,2-3,6-9,12H2,1H3 | CCCc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3)C#N | |
| AKOS005253445 | 468.507 | C17 H20 N6 O6 S2 | CGDUGKLSDCFFOL-UHFFFAOYSA-N | InChI=1S/C17H20N6O6S2/c1-3-22-15(25)12(23(17(22)30)9-13-16(26)29-20-21(13)2)8-14(24)19-10-4-6-11(7-5-10)31(18,27)28/h4-7,12H,3,8-9H2,1-2H3,(H3-,18,19,20,24,26,27,28) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)S(=O)(=O)N | |
| AKOS005214330 | 299.368 | C17 H21 N3 O2 | KHWJAQYBOVTDLD-UHFFFAOYSA-N | InChI=1S/C17H21N3O2/c21-17-16(13-18-12-11-14-7-3-1-4-8-14)20(19-22-17)15-9-5-2-6-10-15/h2,5-7,9-10,18H,1,3-4,8,11-13H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCCC3=CCCCC3 | |
| AKOS005250260 | 315.367 | C17 H21 N3 O3 | VSYYERSXIASTIX-UHFFFAOYSA-N | InChI=1S/C17H21N3O3/c1-19(16(21)13-8-4-2-5-9-13)12-15-17(22)23-18-20(15)14-10-6-3-7-11-14/h3,6-7,10-11,13H,2,4-5,8-9,12H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)C3CCCCC3 | |
| AKOS005250339 | 315.367 | C17 H21 N3 O3 | OPMRTXUNLJDWHJ-UHFFFAOYSA-N | InChI=1S/C17H21N3O3/c1-2-3-9-16(21)19(13-10-11-13)12-15-17(22)23-18-20(15)14-7-5-4-6-8-14/h4-8,13H,2-3,9-12H2,1H3 | CCCCC(=O)N(Cc1c(on[n+]1c2ccccc2)[O-])C3CC3 | |
| AKOS005250166 | 331.366 | C17 H21 N3 O4 | BPTPMGJHQOOCMR-UHFFFAOYSA-N | InChI=1S/C17H21N3O4/c1-23-14-10-8-13(9-11-14)20-15(17(22)24-19-20)16(21)18-12-6-4-2-3-5-7-12/h8-12H,2-7H2,1H3,(H-,18,19,21,22) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NC3CCCCCC3 | |
| AKOS005250281 | 331.366 | C17 H21 N3 O4 | ORJVTZVXRQCYDY-UHFFFAOYSA-N | InChI=1S/C17H21N3O4/c1-3-4-16(21)19(12-5-6-12)11-15-17(22)24-18-20(15)13-7-9-14(23-2)10-8-13/h7-10,12H,3-6,11H2,1-2H3 | CCCC(=O)N(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C3CC3 | |
| AKOS005250552 | 379.431 | C17 H21 N3 O5 S | BYCYISQYHMLKGS-UHFFFAOYSA-N | InChI=1S/C17H21N3O5S/c1-3-24-16(22)12-10-8-6-4-5-7-9-11(10)26-15(12)18-14(21)13-17(23)25-19-20(13)2/h3-9H2,1-2H3,(H-,18,19,21,22,23) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3C)[O-])CCCCCC2 | |
| AKOS005251485 | 379.431 | C17 H21 N3 O5 S | FAQWCDHYZQPOFF-UHFFFAOYSA-N | InChI=1S/C17H21N3O5S/c1-4-5-10-24-16(22)12-6-8-13(9-7-12)18-14(21)11(2)26-15-17(23)25-19-20(15)3/h6-9,11H,4-5,10H2,1-3H3,(H-,18,19,21,22,23) | CCCCOC(=O)c1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2C)[O-] | |
| AKOS005252321 | 379.431 | C17 H21 N3 O5 S | ASGLOTMUGXFXGU-UHFFFAOYSA-N | InChI=1S/C17H21N3O5S/c1-3-4-10-24-16(22)12-5-7-13(8-6-12)18-14(21)9-11-26-15-17(23)25-19-20(15)2/h5-8H,3-4,9-11H2,1-2H3,(H-,18,19,21,22,23) | CCCCOC(=O)c1ccc(cc1)NC(=O)CCSc2c(on[n+]2C)[O-] | |
| AKOS005251577 | 411.496 | C17 H21 N3 O5 S2 | GSHWJXKFISJCKO-UHFFFAOYSA-N | InChI=1S/C17H21N3O5S2/c1-3-24-16(22)13-10-7-5-4-6-8-11(10)27-14(13)18-12(21)9-26-15-17(23)25-19-20(15)2/h3-9H2,1-2H3,(H-,18,19,21,22,23) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3C)[O-])CCCCC2 | |
| AKOS005251584 | 411.496 | C17 H21 N3 O5 S2 | AESHBDIWWYFZEJ-UHFFFAOYSA-N | InChI=1S/C17H21N3O5S2/c1-20-15(17(23)25-19-20)26-9-12(21)18-14-13(16(22)24-2)10-7-5-3-4-6-8-11(10)27-14/h3-9H2,1-2H3,(H-,18,19,21,22,23) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2c(c3c(s2)CCCCCC3)C(=O)OC | |
| AKOS005251601 | 411.496 | C17 H21 N3 O5 S2 | QFUBXTVLXJTFNQ-UHFFFAOYSA-N | InChI=1S/C17H21N3O5S2/c1-4-24-16(22)13-10-6-5-9(2)7-11(10)27-14(13)18-12(21)8-26-15-17(23)25-19-20(15)3/h9H,4-8H2,1-3H3,(H-,18,19,21,22,23) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3C)[O-])CC(CC2)C | |
| AKOS005251743 | 411.496 | C17 H21 N3 O5 S2 | QHAFYKLCPDWDNG-UHFFFAOYSA-N | InChI=1S/C17H21N3O5S2/c1-8-5-6-10-11(7-8)27-14(12(10)16(22)24-4)18-13(21)9(2)26-15-17(23)25-19-20(15)3/h8-9H,5-7H2,1-4H3,(H-,18,19,21,22,23) | CC1CCc2c(sc(c2C(=O)OC)NC(=O)C(C)Sc3c(on[n+]3C)[O-])C1 | |
| AKOS005251744 | 411.496 | C17 H21 N3 O5 S2 | KYYPZNABFJQFON-UHFFFAOYSA-N | InChI=1S/C17H21N3O5S2/c1-4-24-16(22)12-10-7-5-6-8-11(10)27-14(12)18-13(21)9(2)26-15-17(23)25-19-20(15)3/h9H,4-8H2,1-3H3,(H-,18,19,21,22,23) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3C)[O-])CCCC2 | |
| AKOS005251825 | 411.496 | C17 H21 N3 O5 S2 | SPMVNDAOKGUGQE-UHFFFAOYSA-N | InChI=1S/C17H21N3O5S2/c1-9(26-15-17(23)25-19-20(15)2)13(21)18-14-12(16(22)24-3)10-7-5-4-6-8-11(10)27-14/h9H,4-8H2,1-3H3,(H-,18,19,21,22,23) | CC(C(=O)Nc1c(c2c(s1)CCCCC2)C(=O)OC)Sc3c(on[n+]3C)[O-] | |
| AKOS005251930 | 411.496 | C17 H21 N3 O5 S2 | RKSRJQMKOWRKGL-UHFFFAOYSA-N | InChI=1S/C17H21N3O5S2/c1-4-10(27-15-17(23)25-19-20(15)2)13(21)18-14-12(16(22)24-3)9-7-5-6-8-11(9)26-14/h10H,4-8H2,1-3H3,(H-,18,19,21,22,23) | CCC(C(=O)Nc1c(c2c(s1)CCCC2)C(=O)OC)Sc3c(on[n+]3C)[O-] | |
| AKOS005252539 | 411.496 | C17 H21 N3 O5 S2 | YCKRNGJWGHLQGO-UHFFFAOYSA-N | InChI=1S/C17H21N3O5S2/c1-20-15(17(23)25-19-20)26-9-8-12(21)18-14-13(16(22)24-2)10-6-4-3-5-7-11(10)27-14/h3-9H2,1-2H3,(H-,18,19,21,22,23) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2c(c3c(s2)CCCCC3)C(=O)OC | |
| AKOS005252660 | 411.496 | C17 H21 N3 O5 S2 | DLNGSLLNXWVCKE-UHFFFAOYSA-N | InChI=1S/C17H21N3O5S2/c1-9-4-5-10-11(8-9)27-14(13(10)16(22)24-3)18-12(21)6-7-26-15-17(23)25-19-20(15)2/h9H,4-8H2,1-3H3,(H-,18,19,21,22,23) | CC1CCc2c(sc(c2C(=O)OC)NC(=O)CCSc3c(on[n+]3C)[O-])C1 | |
| AKOS005252661 | 411.496 | C17 H21 N3 O5 S2 | TYVCKHNKDMQZPS-UHFFFAOYSA-N | InChI=1S/C17H21N3O5S2/c1-3-24-16(22)13-10-6-4-5-7-11(10)27-14(13)18-12(21)8-9-26-15-17(23)25-19-20(15)2/h3-9H2,1-2H3,(H-,18,19,21,22,23) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3C)[O-])CCCC2 | |
| AKOS005252836 | 359.446 | C17 H21 N5 O2 S | QZIBJIKFMFKUHJ-UHFFFAOYSA-N | InChI=1S/C17H21N5O2S/c1-11(2)7-14-6-5-13(8-18)17(19-14)25-10-15(23)20-16-9-22(12(3)4)21-24-16/h5-6,9,11-12H,7,10H2,1-4H3 | CC(C)Cc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)C(C)C)C#N | |
| AKOS005252844 | 359.446 | C17 H21 N5 O2 S | BOTLCVKUIRFMKD-UHFFFAOYSA-N | InChI=1S/C17H21N5O2S/c1-4-5-6-14-8-7-13(9-18)17(19-14)25-11-15(23)20-16-10-22(12(2)3)21-24-16/h7-8,10,12H,4-6,11H2,1-3H3 | CCCCc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)C(C)C)C#N | |
| AKOS005253303 | 375.445 | C17 H21 N5 O3 S | SEIBBINCSRHBQW-UHFFFAOYSA-N | InChI=1S/C17H21N5O3S/c1-12(2)8-14-5-4-13(9-18)17(19-14)26-11-15(23)20-16-10-22(21-25-16)6-7-24-3/h4-5,10,12H,6-8,11H2,1-3H3 | CC(C)Cc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)CCOC)C#N | |
| AKOS005253305 | 375.445 | C17 H21 N5 O3 S | CPHVKMSDYSLBJK-UHFFFAOYSA-N | InChI=1S/C17H21N5O3S/c1-3-4-5-14-7-6-13(10-18)17(19-14)26-12-15(23)20-16-11-22(21-25-16)8-9-24-2/h6-7,11H,3-5,8-9,12H2,1-2H3 | CCCCc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)CCOC)C#N | |
| AKOS005251374 | 359.38 | C17 H21 N5 O4 | YVLVJQORORUFKB-UHFFFAOYSA-O | InChI=1S/C17H20N5O4/c1-21(2)10-9-18-16(24)13(11-14-17(25)26-20-22(14)3)19-15(23)12-7-5-4-6-8-12/h4-8,11H,9-10H2,1-3H3,(H,18,24)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCN(C)C)\NC(=O)c2ccccc2 | |
| AKOS005214835 | 301.383 | C17 H23 N3 O2 | XUTLMZFGXUVJSP-UHFFFAOYSA-N | InChI=1S/C17H23N3O2/c1-13-8-10-15(11-9-13)20-16(17(21)22-19-20)12-18-14-6-4-2-3-5-7-14/h8-11,14,18H,2-7,12H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CCCCCC3 | |
| AKOS005214832 | 317.383 | C17 H23 N3 O3 | AACYRAKYYWGOMO-UHFFFAOYSA-N | InChI=1S/C17H23N3O3/c1-22-15-10-8-14(9-11-15)20-16(17(21)23-19-20)12-18-13-6-4-2-3-5-7-13/h8-11,13,18H,2-7,12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CCCCCC3 | |
| AKOS005250319 | 333.382 | C17 H23 N3 O4 | FQVCXNMWDIOLTC-UHFFFAOYSA-N | InChI=1S/C17H23N3O4/c1-17(2,3)10-15(21)19(4)11-14-16(22)24-18-20(14)12-6-8-13(23-5)9-7-12/h6-9H,10-11H2,1-5H3 | CC(C)(C)CC(=O)N(C)Cc1c(on[n+]1c2ccc(cc2)OC)[O-] | |
| AKOS005252097 | 365.447 | C17 H23 N3 O4 S | FIDQBIZWIVTKEP-UHFFFAOYSA-N | InChI=1S/C17H23N3O4S/c1-4-6-11-23-13-9-7-12(8-10-13)18-15(21)14(5-2)25-16-17(22)24-19-20(16)3/h7-10,14H,4-6,11H2,1-3H3,(H-,18,19,21,22) | CCCCOc1ccc(cc1)NC(=O)C(CC)Sc2c(on[n+]2C)[O-] | |
| AKOS005215630 | 349.382 | C17 H23 N3 O5 | ONFNOQZGTSZNFS-UHFFFAOYSA-N | InChI=1S/C17H23N3O5/c1-17(2,3)24-16(21)18-15-11-20(19-25-15)9-8-12-6-7-13(22-4)14(10-12)23-5/h6-7,10-11H,8-9H2,1-5H3 | CC(C)(C)OC(=O)[N-]c1c[n+](no1)CCc2ccc(c(c2)OC)OC | |
| AKOS005251209 | 467.318 | C17 H8 F7 N3 O3 S | JEORAIQFWVFRAH-UHFFFAOYSA-N | InChI=1S/C17H8F7N3O3S/c18-10-9(17(22,23)24)11(19)13(21)14(12(10)20)25-8(28)6-31-15-16(29)30-26-27(15)7-4-2-1-3-5-7/h1-5H,6H2,(H-,25,26,28,29) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3c(c(c(c(c3F)F)C(F)(F)F)F)F | |
| AKOS005250199 | 451.252 | C17 H8 F7 N3 O4 | RUABESSFLAQYHX-UHFFFAOYSA-N | InChI=1S/C17H8F7N3O4/c1-30-7-4-2-6(3-5-7)27-14(16(29)31-26-27)15(28)25-13-11(20)9(18)8(17(22,23)24)10(19)12(13)21/h2-5H,1H3,(H-,25,26,28,29) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3c(c(c(c(c3F)F)C(F)(F)F)F)F | |
| AKOS005251769 | 481.344 | C18 H10 F7 N3 O3 S | YWLAYDCCHPHAHF-UHFFFAOYSA-N | InChI=1S/C18H10F7N3O3S/c1-7(32-16-17(30)31-27-28(16)8-5-3-2-4-6-8)15(29)26-14-12(21)10(19)9(18(23,24)25)11(20)13(14)22/h2-7H,1H3,(H-,26,27,29,30) | CC(C(=O)Nc1c(c(c(c(c1F)F)C(F)(F)F)F)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252154 | 481.344 | C18 H10 F7 N3 O3 S | XRYNGYDDIJNROV-UHFFFAOYSA-N | InChI=1S/C18H10F7N3O3S/c19-11-10(18(23,24)25)12(20)14(22)15(13(11)21)26-9(29)6-7-32-16-17(30)31-27-28(16)8-4-2-1-3-5-8/h1-5H,6-7H2,(H-,26,27,29,30) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3c(c(c(c(c3F)F)C(F)(F)F)F)F | |
| AKOS005251566 | 497.344 | C18 H10 F7 N3 O4 S | GQOBDOOEFQZETR-UHFFFAOYSA-N | InChI=1S/C18H10F7N3O4S/c1-31-8-4-2-7(3-5-8)28-16(17(30)32-27-28)33-6-9(29)26-15-13(21)11(19)10(18(23,24)25)12(20)14(15)22/h2-5H,6H2,1H3,(H-,26,27,29,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3c(c(c(c(c3F)F)C(F)(F)F)F)F | |
| AKOS005253605 | 504.292 | C18 H11 Br F N7 O3 S | ZTWLJOGPOCSQOU-UHFFFAOYSA-N | InChI=1S/C18H11BrFN7O3S/c1-27-13(18(29)30-26-27)10-7(5-21)15(23)25-17-11(10)12(22)14(31-17)16(28)24-9-3-2-6(19)4-8(9)20/h2-4H,1H3,(H5-,22,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(cc4F)Br)N)N)C#N | |
| AKOS005253661 | 504.292 | C18 H11 Br F N7 O3 S | DZSNGNTZRBOAPO-UHFFFAOYSA-N | InChI=1S/C18H11BrFN7O3S/c1-27-15(18(29)30-26-27)14-9(5-21)16(23)25-17(10(14)6-22)31-7-13(28)24-12-3-2-8(19)4-11(12)20/h2-4H,7H2,1H3,(H3-,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(cc3F)Br)N)C#N | |
| AKOS005253545 | 459.841 | C18 H11 Cl F N7 O3 S | DUMIKKSQZOWUPE-UHFFFAOYSA-N | InChI=1S/C18H11ClFN7O3S/c1-27-15(18(29)30-26-27)14-9(5-21)16(23)25-17(10(14)6-22)31-7-13(28)24-8-2-3-12(20)11(19)4-8/h2-4H,7H2,1H3,(H3-,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(c(c3)Cl)F)N)C#N | |
| AKOS005253589 | 459.841 | C18 H11 Cl F N7 O3 S | OMKAJFZDECWAKH-UHFFFAOYSA-N | InChI=1S/C18H11ClFN7O3S/c1-27-13(18(29)30-26-27)10-7(5-21)15(23)25-17-11(10)12(22)14(31-17)16(28)24-6-2-3-9(20)8(19)4-6/h2-4H,1H3,(H5-,22,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(c(c4)Cl)F)N)N)C#N | |
| AKOS005253844 | 426.836 | C18 H11 Cl N6 O3 S | UDSGAKYHZWJSTP-UHFFFAOYSA-N | InChI=1S/C18H11ClN6O3S/c1-25-13(18(27)28-24-25)14(26)15-12(21)11-10(7-2-4-8(19)5-3-7)9(6-20)16(22)23-17(11)29-15/h2-5H,1H3,(H4-,21,22,23,24,26,27) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4ccc(cc4)Cl)N | |
| AKOS005253421 | 476.296 | C18 H11 Cl2 N7 O3 S | IZFFEIWLARFSCT-UHFFFAOYSA-N | InChI=1S/C18H11Cl2N7O3S/c1-27-13(18(29)30-26-27)10-9(5-21)15(23)25-17-11(10)12(22)14(31-17)16(28)24-8-3-6(19)2-7(20)4-8/h2-4H,1H3,(H5-,22,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4cc(cc(c4)Cl)Cl)N)N)C#N | |
| AKOS005253531 | 476.296 | C18 H11 Cl2 N7 O3 S | UQXYVWCMZJTICH-UHFFFAOYSA-N | InChI=1S/C18H11Cl2N7O3S/c1-27-13(18(29)30-26-27)9-6(5-21)15(23)25-17-10(9)12(22)14(31-17)16(28)24-8-4-2-3-7(19)11(8)20/h2-4H,1H3,(H5-,22,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4cccc(c4Cl)Cl)N)N)C#N | |
| AKOS005253532 | 476.296 | C18 H11 Cl2 N7 O3 S | NNBFUMNBLLIDDQ-UHFFFAOYSA-N | InChI=1S/C18H11Cl2N7O3S/c1-27-13(18(29)30-26-27)10-7(5-21)15(23)25-17-11(10)12(22)14(31-17)16(28)24-9-3-2-6(19)4-8(9)20/h2-4H,1H3,(H5-,22,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(cc4Cl)Cl)N)N)C#N | |
| AKOS005253539 | 476.296 | C18 H11 Cl2 N7 O3 S | PAUHQBYNTNABEU-UHFFFAOYSA-N | InChI=1S/C18H11Cl2N7O3S/c1-27-13(18(29)30-26-27)10-7(5-21)15(23)25-17-11(10)12(22)14(31-17)16(28)24-9-4-6(19)2-3-8(9)20/h2-4H,1H3,(H5-,22,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4cc(ccc4Cl)Cl)N)N)C#N | |
| AKOS005253540 | 476.296 | C18 H11 Cl2 N7 O3 S | QECCHWONELKBGO-UHFFFAOYSA-N | InChI=1S/C18H11Cl2N7O3S/c1-27-13(18(29)30-26-27)10-7(5-21)15(23)25-17-11(10)12(22)14(31-17)16(28)24-6-2-3-8(19)9(20)4-6/h2-4H,1H3,(H5-,22,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(c(c4)Cl)Cl)N)N)C#N | |
| AKOS005253547 | 476.296 | C18 H11 Cl2 N7 O3 S | UPUUJXGUWIQPFG-UHFFFAOYSA-N | InChI=1S/C18H11Cl2N7O3S/c1-27-15(18(29)30-26-27)14-11(5-21)16(23)25-17(12(14)6-22)31-7-13(28)24-10-3-8(19)2-9(20)4-10/h2-4H,7H2,1H3,(H3-,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3cc(cc(c3)Cl)Cl)N)C#N | |
| AKOS005253655 | 476.296 | C18 H11 Cl2 N7 O3 S | QBGRLTNVRJLRBU-UHFFFAOYSA-N | InChI=1S/C18H11Cl2N7O3S/c1-27-15(18(29)30-26-27)13-8(5-21)16(23)25-17(9(13)6-22)31-7-12(28)24-11-4-2-3-10(19)14(11)20/h2-4H,7H2,1H3,(H3-,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3cccc(c3Cl)Cl)N)C#N | |
| AKOS005253656 | 476.296 | C18 H11 Cl2 N7 O3 S | GBHRJWKRWZZLPT-UHFFFAOYSA-N | InChI=1S/C18H11Cl2N7O3S/c1-27-15(18(29)30-26-27)14-9(5-21)16(23)25-17(10(14)6-22)31-7-13(28)24-12-3-2-8(19)4-11(12)20/h2-4H,7H2,1H3,(H3-,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(cc3Cl)Cl)N)C#N | |
| AKOS005253663 | 476.296 | C18 H11 Cl2 N7 O3 S | BVEUEEVIJOPWID-UHFFFAOYSA-N | InChI=1S/C18H11Cl2N7O3S/c1-27-15(18(29)30-26-27)14-9(5-21)16(23)25-17(10(14)6-22)31-7-13(28)24-12-4-8(19)2-3-11(12)20/h2-4H,7H2,1H3,(H3-,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3cc(ccc3Cl)Cl)N)C#N | |
| AKOS005253664 | 476.296 | C18 H11 Cl2 N7 O3 S | NEJBQRLRXXNVRY-UHFFFAOYSA-N | InChI=1S/C18H11Cl2N7O3S/c1-27-15(18(29)30-26-27)14-9(5-21)16(23)25-17(10(14)6-22)31-7-13(28)24-8-2-3-11(19)12(20)4-8/h2-4H,7H2,1H3,(H3-,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(c(c3)Cl)Cl)N)C#N | |
| AKOS005253520 | 443.387 | C18 H11 F2 N7 O3 S | NRGDPYREDVXROQ-UHFFFAOYSA-N | InChI=1S/C18H11F2N7O3S/c1-27-13(18(29)30-26-27)10-7(5-21)15(23)25-17-11(10)12(22)14(31-17)16(28)24-6-2-3-8(19)9(20)4-6/h2-4H,1H3,(H5-,22,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(c(c4)F)F)N)N)C#N | |
| AKOS005253586 | 443.387 | C18 H11 F2 N7 O3 S | HVHOHKNQQJTSGY-UHFFFAOYSA-N | InChI=1S/C18H11F2N7O3S/c1-27-15(18(29)30-26-27)14-9(5-21)16(23)25-17(10(14)6-22)31-7-13(28)24-8-2-3-11(19)12(20)4-8/h2-4H,7H2,1H3,(H3-,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(c(c3)F)F)N)C#N | |
| AKOS005219510 | 420.365 | C18 H11 F3 N4 O3 S | NBGJHNDTHKGAIJ-UHFFFAOYSA-N | InChI=1S/C18H11F3N4O3S/c1-10-7-13(18(19,20)21)12(8-22)16(23-10)29-9-14(26)15-17(27)28-24-25(15)11-5-3-2-4-6-11/h2-7H,9H2,1H3 | Cc1cc(c(c(n1)SCC(=O)c2c(on[n+]2c3ccccc3)[O-])C#N)C(F)(F)F | |
| AKOS005250696 | 420.365 | C18 H11 F3 N4 O3 S | VDGSFEBPSNWJCO-UHFFFAOYSA-N | InChI=1S/C18H11F3N4O3S/c1-25-15(17(27)28-24-25)14(26)9-29-16-11(8-22)12(18(19,20)21)7-13(23-16)10-5-3-2-4-6-10/h2-7H,9H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2c(c(cc(n2)c3ccccc3)C(F)(F)F)C#N | |
| AKOS005250828 | 420.365 | C18 H11 F3 N4 O3 S | KZMJRDMOTFGBOZ-UHFFFAOYSA-N | InChI=1S/C18H11F3N4O3S/c1-10-7-14(18(19,20)21)23-16(12(10)8-22)29-9-13(26)15-17(27)28-24-25(15)11-5-3-2-4-6-11/h2-7H,9H2,1H3 | Cc1cc(nc(c1C#N)SCC(=O)c2c(on[n+]2c3ccccc3)[O-])C(F)(F)F | |
| AKOS005253803 | 420.365 | C18 H11 F3 N4 O3 S | QRMVXWOWXMAZPJ-UHFFFAOYSA-N | InChI=1S/C18H11F3N4O3S/c1-8-7-10(18(19,20)21)23-16-11(8)12(22)15(29-16)14(26)13-17(27)28-24-25(13)9-5-3-2-4-6-9/h2-7H,1H3,(H2-,22,24,26,27) | Cc1cc(nc2c1c(c(s2)C(=O)c3c(on[n+]3c4ccccc4)[O-])N)C(F)(F)F | |
| AKOS005253840 | 420.365 | C18 H11 F3 N4 O3 S | QZBUEBGORJJGHP-UHFFFAOYSA-N | InChI=1S/C18H11F3N4O3S/c1-25-13(17(27)28-24-25)14(26)15-12(22)11-9(18(19,20)21)7-10(23-16(11)29-15)8-5-3-2-4-6-8/h2-7H,1H3,(H2-,22,24,26,27) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4ccccc4)C(F)(F)F)N | |
| AKOS005219781 | 333.298 | C18 H11 N3 O4 | YTYGEIOPRZALHO-UHFFFAOYSA-N | InChI=1S/C18H11N3O4/c22-17-14(19-16(24-17)12-7-3-1-4-8-12)11-15-18(23)25-20-21(15)13-9-5-2-6-10-13/h1-11H | c1ccc(cc1)C2=N/C(=C\c3c(on[n+]3c4ccccc4)[O-])/C(=O)O2 | |
| AKOS005250718 | 377.377 | C18 H11 N5 O3 S | QWUOCEYSQIUSQD-UHFFFAOYSA-N | InChI=1S/C18H11N5O3S/c1-23-16(17(25)26-22-23)12(24)8-27-18-19-14-10-6-2-4-9-5-3-7-11(13(9)10)15(14)20-21-18/h2-7H,8H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2nc-3c(nn2)-c4cccc5c4c3ccc5 | |
| AKOS005253634 | 486.302 | C18 H12 Br N7 O3 S | ZVQRFFCTDLIZAP-UHFFFAOYSA-N | InChI=1S/C18H12BrN7O3S/c1-26-13(18(28)29-25-26)10-7(6-20)15(22)24-17-11(10)12(21)14(30-17)16(27)23-9-5-3-2-4-8(9)19/h2-5H,1H3,(H5-,21,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccccc4Br)N)N)C#N | |
| AKOS005253635 | 486.302 | C18 H12 Br N7 O3 S | BNLGCRCBLSJWNT-UHFFFAOYSA-N | InChI=1S/C18H12BrN7O3S/c1-26-13(18(28)29-25-26)10-9(6-20)15(22)24-17-11(10)12(21)14(30-17)16(27)23-8-4-2-7(19)3-5-8/h2-5H,1H3,(H5-,21,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(cc4)Br)N)N)C#N | |
| AKOS005253653 | 486.302 | C18 H12 Br N7 O3 S | UNNNLQUSTHPUEV-UHFFFAOYSA-N | InChI=1S/C18H12BrN7O3S/c1-26-15(18(28)29-25-26)14-9(6-20)16(22)24-17(10(14)7-21)30-8-13(27)23-12-5-3-2-4-11(12)19/h2-5H,8H2,1H3,(H3-,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccccc3Br)N)C#N | |
| AKOS005253654 | 486.302 | C18 H12 Br N7 O3 S | HFEYOLVCCRLIQG-UHFFFAOYSA-N | InChI=1S/C18H12BrN7O3S/c1-26-15(18(28)29-25-26)14-11(6-20)16(22)24-17(12(14)7-21)30-8-13(27)23-10-4-2-9(19)3-5-10/h2-5H,8H2,1H3,(H3-,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(cc3)Br)N)C#N | |
| AKOS005253606 | 441.851 | C18 H12 Cl N7 O3 S | QVZLMIAMQIKIOO-UHFFFAOYSA-N | InChI=1S/C18H12ClN7O3S/c1-26-13(18(28)29-25-26)10-7(6-20)15(22)24-17-11(10)12(21)14(30-17)16(27)23-9-5-3-2-4-8(9)19/h2-5H,1H3,(H5-,21,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccccc4Cl)N)N)C#N | |
| AKOS005253628 | 441.851 | C18 H12 Cl N7 O3 S | KPGKLHZPADKLLA-UHFFFAOYSA-N | InChI=1S/C18H12ClN7O3S/c1-26-13(18(28)29-25-26)10-9(6-20)15(22)24-17-11(10)12(21)14(30-17)16(27)23-8-4-2-3-7(19)5-8/h2-5H,1H3,(H5-,21,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4cccc(c4)Cl)N)N)C#N | |
| AKOS005253629 | 441.851 | C18 H12 Cl N7 O3 S | FYBKWBHWNCSWDB-UHFFFAOYSA-N | InChI=1S/C18H12ClN7O3S/c1-26-13(18(28)29-25-26)10-9(6-20)15(22)24-17-11(10)12(21)14(30-17)16(27)23-8-4-2-7(19)3-5-8/h2-5H,1H3,(H5-,21,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(cc4)Cl)N)N)C#N | |
| AKOS005253662 | 441.851 | C18 H12 Cl N7 O3 S | XMAJMXKRARBISQ-UHFFFAOYSA-N | InChI=1S/C18H12ClN7O3S/c1-26-15(18(28)29-25-26)14-9(6-20)16(22)24-17(10(14)7-21)30-8-13(27)23-12-5-3-2-4-11(12)19/h2-5H,8H2,1H3,(H3-,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccccc3Cl)N)C#N | |
| AKOS005253669 | 441.851 | C18 H12 Cl N7 O3 S | VEXWUGBZZMXGOW-UHFFFAOYSA-N | InChI=1S/C18H12ClN7O3S/c1-26-15(18(28)29-25-26)14-11(6-20)16(22)24-17(12(14)7-21)30-8-13(27)23-10-4-2-3-9(19)5-10/h2-5H,8H2,1H3,(H3-,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3cccc(c3)Cl)N)C#N | |
| AKOS005253670 | 441.851 | C18 H12 Cl N7 O3 S | VZFPVYWGXCQTPQ-UHFFFAOYSA-N | InChI=1S/C18H12ClN7O3S/c1-26-15(18(28)29-25-26)14-11(6-20)16(22)24-17(12(14)7-21)30-8-13(27)23-10-4-2-9(19)3-5-10/h2-5H,8H2,1H3,(H3-,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(cc3)Cl)N)C#N | |
| AKOS005253432 | 425.396 | C18 H12 F N7 O3 S | QEBIGSNAQUECIF-UHFFFAOYSA-N | InChI=1S/C18H12FN7O3S/c1-26-13(18(28)29-25-26)10-7(6-20)15(22)24-17-11(10)12(21)14(30-17)16(27)23-9-5-3-2-4-8(9)19/h2-5H,1H3,(H5-,21,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccccc4F)N)N)C#N | |
| AKOS005253433 | 425.396 | C18 H12 F N7 O3 S | LGIQPAHOPPANBP-UHFFFAOYSA-N | InChI=1S/C18H12FN7O3S/c1-26-13(18(28)29-25-26)10-9(6-20)15(22)24-17-11(10)12(21)14(30-17)16(27)23-8-4-2-7(19)3-5-8/h2-5H,1H3,(H5-,21,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(cc4)F)N)N)C#N | |
| AKOS005253562 | 425.396 | C18 H12 F N7 O3 S | QOHMYMROQJIDCF-UHFFFAOYSA-N | InChI=1S/C18H12FN7O3S/c1-26-15(18(28)29-25-26)14-9(6-20)16(22)24-17(10(14)7-21)30-8-13(27)23-12-5-3-2-4-11(12)19/h2-5H,8H2,1H3,(H3-,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccccc3F)N)C#N | |
| AKOS005253563 | 425.396 | C18 H12 F N7 O3 S | GZNGXGBHDRIOQH-UHFFFAOYSA-N | InChI=1S/C18H12FN7O3S/c1-26-15(18(28)29-25-26)14-11(6-20)16(22)24-17(12(14)7-21)30-8-13(27)23-10-4-2-9(19)3-5-10/h2-5H,8H2,1H3,(H3-,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(cc3)F)N)C#N | |
| AKOS005252534 | 419.38 | C18 H12 F3 N5 O2 S | RBDIZKCWWDJWQX-UHFFFAOYSA-N | InChI=1S/C18H12F3N5O2S/c1-26-9-16(28-25-26)24-15(27)10-29-17-12(8-22)13(18(19,20)21)7-14(23-17)11-5-3-2-4-6-11/h2-7,9H,10H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)C(F)(F)F)C#N | |
| AKOS005253434 | 533.302 | C18 H12 I N7 O3 S | VHVWPBUCFRUYDJ-UHFFFAOYSA-N | InChI=1S/C18H12IN7O3S/c1-26-13(18(28)29-25-26)10-9(6-20)15(22)24-17-11(10)12(21)14(30-17)16(27)23-8-4-2-7(19)3-5-8/h2-5H,1H3,(H5-,21,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(cc4)I)N)N)C#N | |
| AKOS005253564 | 533.302 | C18 H12 I N7 O3 S | MTGIURRVZKIVIL-UHFFFAOYSA-N | InChI=1S/C18H12IN7O3S/c1-26-15(18(28)29-25-26)14-11(6-20)16(22)24-17(12(14)7-21)30-8-13(27)23-10-4-2-9(19)3-5-10/h2-5H,8H2,1H3,(H3-,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(cc3)I)N)C#N | |
| AKOS005215690 | 288.3 | C18 H12 N2 O2 | QFTSQZUMLUKVIE-YRNVUSSQSA-N | InChI=1S/C18H12N2O2/c21-18-17(14-8-7-11-15-9-3-1-4-10-15)20(19-22-18)16-12-5-2-6-13-16/h1-7,9-13H/b11-7+ | c1ccc(cc1)/C=C/C#Cc2c(on[n+]2c3ccccc3)[O-] | MFCD09881646 |
| AKOS005215726 | 320.299 | C18 H12 N2 O4 | HPZZBONBAOYFFZ-UHFFFAOYSA-N | InChI=1S/C18H12N2O4/c1-23-17(21)14-10-7-13(8-11-14)9-12-16-18(22)24-19-20(16)15-5-3-2-4-6-15/h2-8,10-11H,1H3 | COC(=O)c1ccc(cc1)C#Cc2c(on[n+]2c3ccccc3)[O-] | MFCD09881641 |
| AKOS005219863 | 364.378 | C18 H12 N4 O3 S | FRMGRCJGHFQNDH-UHFFFAOYSA-O | InChI=1S/C18H11N4O3S/c23-16-14(19-18(26)21(16)12-7-3-1-4-8-12)11-15-17(24)25-20-22(15)13-9-5-2-6-10-13/h1-11H/q-1/p+1 | c1ccc(cc1)[n+]2c(c(on2)[O-])/C=C\3/C(=O)N(C(=N3)S)c4ccccc4 | |
| AKOS005253891 | 396.377 | C18 H12 N4 O5 S | KIUMUCNQTIWTQQ-UHFFFAOYSA-N | InChI=1S/C18H12N4O5S/c1-22-14(18(24)27-21-22)15(23)16-13(19)9-3-4-10(20-17(9)28-16)8-2-5-11-12(6-8)26-7-25-11/h2-6H,7H2,1H3,(H2-,19,21,23,24) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3ccc(nc3s2)c4ccc5c(c4)OCO5)N | |
| AKOS005252583 | 376.392 | C18 H12 N6 O2 S | IWCRPQUCJYUETL-UHFFFAOYSA-N | InChI=1S/C18H12N6O2S/c1-24-8-14(26-23-24)19-13(25)9-27-18-20-16-11-6-2-4-10-5-3-7-12(15(10)11)17(16)21-22-18/h2-8H,9H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2nc-3c(nn2)-c4cccc5c4c3ccc5 | |
| AKOS005250755 | 392.391 | C18 H12 N6 O3 S | HRJCBFFVHSKSAO-UHFFFAOYSA-N | InChI=1S/C18H12N6O3S/c1-24-15(18(26)27-23-24)13(25)9-28-17-12(8-20)14(10-5-3-2-4-6-10)11(7-19)16(21)22-17/h2-6H,9H2,1H3,(H2-,21,22,23,25,26) | C[n+]1c(c(on1)[O-])C(=O)CSc2c(c(c(c(n2)N)C#N)c3ccccc3)C#N | |
| AKOS005253859 | 392.391 | C18 H12 N6 O3 S | OOWXLNZGDVYJAM-UHFFFAOYSA-N | InChI=1S/C18H12N6O3S/c1-24-13(18(26)27-23-24)14(25)15-12(20)11-10(8-5-3-2-4-6-8)9(7-19)16(21)22-17(11)28-15/h2-6H,1H3,(H4-,20,21,22,23,25,26) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4ccccc4)N | |
| AKOS005253541 | 452.403 | C18 H12 N8 O5 S | QHLZMOHCJNEQNJ-UHFFFAOYSA-N | InChI=1S/C18H12N8O5S/c1-25-13(18(28)31-24-25)10-9(6-19)15(21)23-17-11(10)12(20)14(32-17)16(27)22-7-2-4-8(5-3-7)26(29)30/h2-5H,1H3,(H5-,20,21,22,23,24,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(cc4)N(=O)=O)N)N)C#N | |
| AKOS005253665 | 452.403 | C18 H12 N8 O5 S | FVFHPKDUEGPMKK-UHFFFAOYSA-N | InChI=1S/C18H12N8O5S/c1-25-15(18(28)31-24-25)14-11(6-19)16(21)23-17(12(14)7-20)32-8-13(27)22-9-2-4-10(5-3-9)26(29)30/h2-5H,8H2,1H3,(H3-,21,22,23,24,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(cc3)N(=O)=O)N)C#N | |
| AKOS005251422 | 443.827 | C18 H13 Cl F3 N3 O3 S | WIZBKQOXBRYYEF-UHFFFAOYSA-N | InChI=1S/C18H13ClF3N3O3S/c1-10(15(26)23-14-8-7-11(19)9-13(14)18(20,21)22)29-16-17(27)28-24-25(16)12-5-3-2-4-6-12/h2-10H,1H3,(H-,23,24,26,27) | CC(C(=O)Nc1ccc(cc1C(F)(F)F)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251461 | 443.827 | C18 H13 Cl F3 N3 O3 S | HZUZZEYMODIRAY-UHFFFAOYSA-N | InChI=1S/C18H13ClF3N3O3S/c1-10(15(26)23-14-9-11(18(20,21)22)7-8-13(14)19)29-16-17(27)28-24-25(16)12-5-3-2-4-6-12/h2-10H,1H3,(H-,23,24,26,27) | CC(C(=O)Nc1cc(ccc1Cl)C(F)(F)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252244 | 443.827 | C18 H13 Cl F3 N3 O3 S | NGSQLQOBUZJVGN-UHFFFAOYSA-N | InChI=1S/C18H13ClF3N3O3S/c19-13-7-6-11(18(20,21)22)10-14(13)23-15(26)8-9-29-16-17(27)28-24-25(16)12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H-,23,24,26,27) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cc(ccc3Cl)C(F)(F)F | |
| AKOS005252314 | 443.827 | C18 H13 Cl F3 N3 O3 S | YGOIIVRXMRKPBG-UHFFFAOYSA-N | InChI=1S/C18H13ClF3N3O3S/c19-11-6-7-14(13(10-11)18(20,21)22)23-15(26)8-9-29-16-17(27)28-24-25(16)12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H-,23,24,26,27) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3C(F)(F)F)Cl | |
| AKOS005251641 | 459.827 | C18 H13 Cl F3 N3 O4 S | BFUUWVJMJSUPPE-UHFFFAOYSA-N | InChI=1S/C18H13ClF3N3O4S/c1-28-12-5-3-11(4-6-12)25-16(17(27)29-24-25)30-9-15(26)23-14-7-2-10(19)8-13(14)18(20,21)22/h2-8H,9H2,1H3,(H-,23,24,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3C(F)(F)F)Cl | |
| AKOS005251642 | 459.827 | C18 H13 Cl F3 N3 O4 S | ZDVZABOIDLEJIR-UHFFFAOYSA-N | InChI=1S/C18H13ClF3N3O4S/c1-28-12-5-3-11(4-6-12)25-16(17(27)29-24-25)30-9-15(26)23-14-8-10(18(20,21)22)2-7-13(14)19/h2-8H,9H2,1H3,(H-,23,24,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cc(ccc3Cl)C(F)(F)F | |
| AKOS005251997 | 427.373 | C18 H13 F4 N3 O3 S | RBDZPIYVQRRNHB-UHFFFAOYSA-N | InChI=1S/C18H13F4N3O3S/c1-2-12(16(26)23-15-13(21)10(19)8-11(20)14(15)22)29-17-18(27)28-24-25(17)9-6-4-3-5-7-9/h3-8,12H,2H2,1H3,(H-,23,24,26,27) | CCC(C(=O)Nc1c(c(cc(c1F)F)F)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251846 | 443.372 | C18 H13 F4 N3 O4 S | LJQNOMAVUISSCO-UHFFFAOYSA-N | InChI=1S/C18H13F4N3O4S/c1-8(16(26)23-15-13(21)11(19)7-12(20)14(15)22)30-17-18(27)29-24-25(17)9-3-5-10(28-2)6-4-9/h3-8H,1-2H3,(H-,23,24,26,27) | CC(C(=O)Nc1c(c(cc(c1F)F)F)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252173 | 443.372 | C18 H13 F4 N3 O4 S | MUKHXSDFQHFSPK-UHFFFAOYSA-N | InChI=1S/C18H13F4N3O4S/c1-28-10-4-2-9(3-5-10)25-17(18(27)29-24-25)30-7-6-13(26)23-16-14(21)11(19)8-12(20)15(16)22/h2-5,8H,6-7H2,1H3,(H-,23,24,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3c(c(cc(c3F)F)F)F | |
| AKOS005250401 | 383.378 | C18 H13 N3 O5 S | YERLNNDZESOMBU-UHFFFAOYSA-N | InChI=1S/C18H13N3O5S/c1-24-12-8-6-11(7-9-12)21-16(17(23)26-20-21)14(22)10-27-18-19-13-4-2-3-5-15(13)25-18/h2-9H,10H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nc4ccccc4o3 | |
| AKOS005252519 | 391.407 | C18 H13 N7 O2 S | RYKAVOZTUTURJD-UHFFFAOYSA-N | InChI=1S/C18H13N7O2S/c1-25-9-15(27-24-25)22-14(26)10-28-18-13(8-20)16(11-5-3-2-4-6-11)12(7-19)17(21)23-18/h2-6,9H,10H2,1H3,(H2-,21,22,23,24,26) | C[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3ccccc3)C#N | |
| AKOS005253203 | 407.406 | C18 H13 N7 O3 S | UYTQAZDBSRRQOR-UHFFFAOYSA-N | InChI=1S/C18H13N7O3S/c1-25-15(18(27)28-24-25)14-11(7-19)16(21)23-17(12(14)8-20)29-9-13(26)22-10-5-3-2-4-6-10/h2-6H,9H2,1H3,(H3-,21,22,23,24,26,27) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccccc3)N)C#N | |
| AKOS005253582 | 407.406 | C18 H13 N7 O3 S | HMHQVBURZIVMKS-UHFFFAOYSA-N | InChI=1S/C18H13N7O3S/c1-25-13(18(27)28-24-25)10-9(7-19)15(21)23-17-11(10)12(20)14(29-17)16(26)22-8-5-3-2-4-6-8/h2-6H,1H3,(H5-,20,21,22,23,24,26,27) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccccc4)N)N)C#N | |
| AKOS005253672 | 407.406 | C18 H13 N7 O3 S | BJNGVSQMRPSEAQ-UHFFFAOYSA-N | InChI=1S/C18H13N7O3S/c1-7-4-3-5-9(22-7)10-8(6-19)16(21)23-17-11(10)12(20)15(29-17)14(26)13-18(27)28-24-25(13)2/h3-5H,1-2H3,(H4-,20,21,23,24,26,27) | Cc1cccc(n1)c2c(c(nc3c2c(c(s3)C(=O)c4c(on[n+]4C)[O-])N)N)C#N | |
| AKOS005251766 | 419.839 | C18 H14 Cl N3 O5 S | XJYHLAIYKIUMNW-UHFFFAOYSA-N | InChI=1S/C18H14ClN3O5S/c1-10(15(23)20-11-7-8-14(19)13(9-11)17(24)25)28-16-18(26)27-21-22(16)12-5-3-2-4-6-12/h2-10H,1H3,(H2-,20,21,23,24,25,26) | CC(C(=O)Nc1ccc(c(c1)C(=O)O)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251767 | 419.839 | C18 H14 Cl N3 O5 S | LTLUJTVODYGTOU-UHFFFAOYSA-N | InChI=1S/C18H14ClN3O5S/c1-10(15(23)20-14-9-11(17(24)25)7-8-13(14)19)28-16-18(26)27-21-22(16)12-5-3-2-4-6-12/h2-10H,1H3,(H2-,20,21,23,24,25,26) | CC(C(=O)Nc1cc(ccc1Cl)C(=O)O)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252258 | 419.839 | C18 H14 Cl N3 O5 S | LKUSVBOLJVGLGH-UHFFFAOYSA-N | InChI=1S/C18H14ClN3O5S/c19-14-7-6-11(10-13(14)17(24)25)20-15(23)8-9-28-16-18(26)27-21-22(16)12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H2-,20,21,23,24,25,26) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(c(c3)C(=O)O)Cl | |
| AKOS005252259 | 419.839 | C18 H14 Cl N3 O5 S | XTWANKDKQUFBIK-UHFFFAOYSA-N | InChI=1S/C18H14ClN3O5S/c19-13-7-6-11(17(24)25)10-14(13)20-15(23)8-9-28-16-18(26)27-21-22(16)12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H2-,20,21,23,24,25,26) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cc(ccc3Cl)C(=O)O | |
| AKOS005251549 | 435.838 | C18 H14 Cl N3 O6 S | NEGLMUYHTWHKTB-UHFFFAOYSA-N | InChI=1S/C18H14ClN3O6S/c1-27-12-5-3-11(4-6-12)22-16(18(26)28-21-22)29-9-15(23)20-10-2-7-14(19)13(8-10)17(24)25/h2-8H,9H2,1H3,(H2-,20,21,23,24,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(c(c3)C(=O)O)Cl | |
| AKOS005251550 | 435.838 | C18 H14 Cl N3 O6 S | PIOPEFGJEXDJRY-UHFFFAOYSA-N | InChI=1S/C18H14ClN3O6S/c1-27-12-5-3-11(4-6-12)22-16(18(26)28-21-22)29-9-15(23)20-14-8-10(17(24)25)2-7-13(14)19/h2-8H,9H2,1H3,(H2-,20,21,23,24,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cc(ccc3Cl)C(=O)O | |
| AKOS005252907 | 399.854 | C18 H14 Cl N5 O2 S | HEZVTYPGJUVOIZ-UHFFFAOYSA-N | InChI=1S/C18H14ClN5O2S/c1-2-24-10-17(26-23-24)22-16(25)11-27-18-13(9-20)5-8-15(21-18)12-3-6-14(19)7-4-12/h3-8,10H,2,11H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)c3ccc(cc3)Cl)C#N | |
| AKOS005215724 | 377.317 | C18 H14 F3 N3 O3 | LJISZNYJRFXJAN-UHFFFAOYSA-N | InChI=1S/C18H14F3N3O3/c1-11(25)22-17-15(24(23-27-17)14-5-3-2-4-6-14)16(26)12-7-9-13(10-8-12)18(19,20)21/h2-10,16,26H,1H3 | CC(=O)[N-]c1c([n+](no1)c2ccccc2)C(c3ccc(cc3)C(F)(F)F)O | |
| AKOS005251420 | 409.382 | C18 H14 F3 N3 O3 S | MQZLVJWHIFBUHH-UHFFFAOYSA-N | InChI=1S/C18H14F3N3O3S/c1-11(15(25)22-14-10-6-5-9-13(14)18(19,20)21)28-16-17(26)27-23-24(16)12-7-3-2-4-8-12/h2-11H,1H3,(H-,22,23,25,26) | CC(C(=O)Nc1ccccc1C(F)(F)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251429 | 409.382 | C18 H14 F3 N3 O3 S | ONSKHPYRGQGIGG-UHFFFAOYSA-N | InChI=1S/C18H14F3N3O3S/c1-11(15(25)22-13-7-5-6-12(10-13)18(19,20)21)28-16-17(26)27-23-24(16)14-8-3-2-4-9-14/h2-11H,1H3,(H-,22,23,25,26) | CC(C(=O)Nc1cccc(c1)C(F)(F)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252355 | 409.382 | C18 H14 F3 N3 O3 S | OHSMJAOYZKWJRJ-UHFFFAOYSA-N | InChI=1S/C18H14F3N3O3S/c19-18(20,21)13-8-4-5-9-14(13)22-15(25)10-11-28-16-17(26)27-23-24(16)12-6-2-1-3-7-12/h1-9H,10-11H2,(H-,22,23,25,26) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccccc3C(F)(F)F | |
| AKOS005252364 | 409.382 | C18 H14 F3 N3 O3 S | ADEZBPDXWURSEK-UHFFFAOYSA-N | InChI=1S/C18H14F3N3O3S/c19-18(20,21)12-5-4-6-13(11-12)22-15(25)9-10-28-16-17(26)27-23-24(16)14-7-2-1-3-8-14/h1-8,11H,9-10H2,(H-,22,23,25,26) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cccc(c3)C(F)(F)F | |
| AKOS005251171 | 425.382 | C18 H14 F3 N3 O4 S | UGMKLNPDFDDPPA-UHFFFAOYSA-N | InChI=1S/C18H14F3N3O4S/c1-27-12-8-6-11(7-9-12)24-16(17(26)28-23-24)29-10-15(25)22-14-5-3-2-4-13(14)18(19,20)21/h2-9H,10H2,1H3,(H-,22,23,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccccc3C(F)(F)F | |
| AKOS005251172 | 425.382 | C18 H14 F3 N3 O4 S | NNEWHHPUZYJQRL-UHFFFAOYSA-N | InChI=1S/C18H14F3N3O4S/c1-27-14-7-5-13(6-8-14)24-16(17(26)28-23-24)29-10-15(25)22-12-4-2-3-11(9-12)18(19,20)21/h2-9H,10H2,1H3,(H-,22,23,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cccc(c3)C(F)(F)F | |
| AKOS005251772 | 425.382 | C18 H14 F3 N3 O4 S | VLVJGYZDGZZQLO-UHFFFAOYSA-N | InChI=1S/C18H14F3N3O4S/c1-11(15(25)22-12-7-9-14(10-8-12)27-18(19,20)21)29-16-17(26)28-23-24(16)13-5-3-2-4-6-13/h2-11H,1H3,(H-,22,23,25,26) | CC(C(=O)Nc1ccc(cc1)OC(F)(F)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251773 | 425.382 | C18 H14 F3 N3 O4 S | ZAZYXEBEKYBEQX-UHFFFAOYSA-N | InChI=1S/C18H14F3N3O4S/c1-11(15(25)22-13-9-5-6-10-14(13)27-18(19,20)21)29-16-17(26)28-23-24(16)12-7-3-2-4-8-12/h2-11H,1H3,(H-,22,23,25,26) | CC(C(=O)Nc1ccccc1OC(F)(F)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252163 | 425.382 | C18 H14 F3 N3 O4 S | OXZGSQSKPRRTGJ-UHFFFAOYSA-N | InChI=1S/C18H14F3N3O4S/c19-18(20,21)27-14-8-6-12(7-9-14)22-15(25)10-11-29-16-17(26)28-23-24(16)13-4-2-1-3-5-13/h1-9H,10-11H2,(H-,22,23,25,26) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)OC(F)(F)F | |
| AKOS005252164 | 425.382 | C18 H14 F3 N3 O4 S | DZQNGDQBICZKNN-UHFFFAOYSA-N | InChI=1S/C18H14F3N3O4S/c19-18(20,21)27-14-9-5-4-8-13(14)22-15(25)10-11-29-16-17(26)28-23-24(16)12-6-2-1-3-7-12/h1-9H,10-11H2,(H-,22,23,25,26) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccccc3OC(F)(F)F | |
| AKOS005251599 | 441.381 | C18 H14 F3 N3 O5 S | PSSTULVIMTYSBJ-UHFFFAOYSA-N | InChI=1S/C18H14F3N3O5S/c1-27-13-8-4-12(5-9-13)24-16(17(26)29-23-24)30-10-15(25)22-11-2-6-14(7-3-11)28-18(19,20)21/h2-9H,10H2,1H3,(H-,22,23,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)OC(F)(F)F | |
| AKOS005251606 | 441.381 | C18 H14 F3 N3 O5 S | TWGAPQDSZBVSJY-UHFFFAOYSA-N | InChI=1S/C18H14F3N3O5S/c1-27-12-8-6-11(7-9-12)24-16(17(26)29-23-24)30-10-15(25)22-13-4-2-3-5-14(13)28-18(19,20)21/h2-9H,10H2,1H3,(H-,22,23,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccccc3OC(F)(F)F | |
| AKOS005252886 | 453.461 | C18 H14 F3 N5 O2 S2 | QEHQBLAUCZHZBX-UHFFFAOYSA-N | InChI=1S/C18H14F3N5O2S2/c1-10(2)26-8-16(28-25-26)24-15(27)9-30-17-11(7-22)12(18(19,20)21)6-13(23-17)14-4-3-5-29-14/h3-6,8,10H,9H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3cccs3)C(F)(F)F)C#N | |
| AKOS005253297 | 469.461 | C18 H14 F3 N5 O3 S2 | OPDXRWRZWDISBW-UHFFFAOYSA-N | InChI=1S/C18H14F3N5O3S2/c1-28-5-4-26-9-16(29-25-26)24-15(27)10-31-17-11(8-22)12(18(19,20)21)7-13(23-17)14-3-2-6-30-14/h2-3,6-7,9H,4-5,10H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3cccs3)C(F)(F)F)C#N | |
| AKOS005219525 | 366.394 | C18 H14 N4 O3 S | ZIZWBRJEGKWUPF-UHFFFAOYSA-N | InChI=1S/C18H14N4O3S/c1-11-8-12(2)20-17(14(11)9-19)26-10-15(23)16-18(24)25-21-22(16)13-6-4-3-5-7-13/h3-8H,10H2,1-2H3 | Cc1cc(nc(c1C#N)SCC(=O)c2c(on[n+]2c3ccccc3)[O-])C | |
| AKOS005219775 | 366.394 | C18 H14 N4 O3 S | YLHDGZAENGLBQQ-UHFFFAOYSA-O | InChI=1S/C18H12N4O3S/c23-16-14(19-18(26)21(16)12-7-3-1-4-8-12)11-15-17(24)25-20-22(15)13-9-5-2-6-10-13/h1-11H,(H,23,26)/q-1/p+1 | c1ccc(cc1)[n+]2c(c(on2)[O-])/C=C\3/C(=O)N(=C(N3)S)c4ccccc4 | |
| AKOS005250742 | 366.394 | C18 H14 N4 O3 S | XFSAYILTUULZJI-UHFFFAOYSA-N | InChI=1S/C18H14N4O3S/c1-11-3-5-12(6-4-11)14-8-7-13(9-19)17(20-14)26-10-15(23)16-18(24)25-21-22(16)2/h3-8H,10H2,1-2H3 | Cc1ccc(cc1)c2ccc(c(n2)SCC(=O)c3c(on[n+]3C)[O-])C#N | |
| AKOS005251179 | 366.394 | C18 H14 N4 O3 S | OHQLQXJFNHBAAP-UHFFFAOYSA-N | InChI=1S/C18H14N4O3S/c23-16(20-13-6-7-15-12(10-13)8-9-19-15)11-26-17-18(24)25-21-22(17)14-4-2-1-3-5-14/h1-10,21,24H,11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc4c(c3)cc[nH]4 | |
| AKOS005253788 | 366.394 | C18 H14 N4 O3 S | QTKHEPSYAAIOEV-UHFFFAOYSA-N | InChI=1S/C18H14N4O3S/c1-9-8-10(2)20-17-12(9)13(19)16(26-17)15(23)14-18(24)25-21-22(14)11-6-4-3-5-7-11/h3-8H,1-2H3,(H2-,19,21,23,24) | Cc1cc(nc2c1c(c(s2)C(=O)c3c(on[n+]3c4ccccc4)[O-])N)C | |
| AKOS005253789 | 366.394 | C18 H14 N4 O3 S | QMAQWHZERZHMON-UHFFFAOYSA-N | InChI=1S/C18H14N4O3S/c1-9-8-12-13(19)16(26-17(12)20-10(9)2)15(23)14-18(24)25-21-22(14)11-6-4-3-5-7-11/h3-8H,1-2H3,(H2-,19,21,23,24) | Cc1cc2c(c(sc2nc1C)C(=O)c3c(on[n+]3c4ccccc4)[O-])N | |
| AKOS005253857 | 366.394 | C18 H14 N4 O3 S | GXVSUMNLUFONPD-UHFFFAOYSA-N | InChI=1S/C18H14N4O3S/c1-9-3-5-10(6-4-9)12-8-7-11-13(19)16(26-17(11)20-12)15(23)14-18(24)25-21-22(14)2/h3-8H,1-2H3,(H2-,19,21,23,24) | Cc1ccc(cc1)c2ccc3c(c(sc3n2)C(=O)c4c(on[n+]4C)[O-])N | |
| AKOS005253889 | 366.394 | C18 H14 N4 O3 S | RIEOESUKMLZDAB-UHFFFAOYSA-N | InChI=1S/C18H14N4O3S/c1-9-8-11-12(19)16(15(23)14-18(24)25-21-22(14)2)26-17(11)20-13(9)10-6-4-3-5-7-10/h3-8H,1-2H3,(H2-,19,21,23,24) | Cc1cc2c(c(sc2nc1c3ccccc3)C(=O)c4c(on[n+]4C)[O-])N | |
| AKOS005250169 | 350.328 | C18 H14 N4 O4 | FIPYJNCXXLCOAU-UHFFFAOYSA-N | InChI=1S/C18H14N4O4/c1-25-14-5-3-13(4-6-14)22-16(18(24)26-21-22)17(23)20-12-2-7-15-11(10-12)8-9-19-15/h2-10,21H,1H3,(H,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc4c(c3)cc[nH]4 | |
| AKOS005250402 | 382.393 | C18 H14 N4 O4 S | HZDZHLUYOHQNKI-UHFFFAOYSA-N | InChI=1S/C18H14N4O4S/c1-25-12-8-6-11(7-9-12)22-16(17(24)26-21-22)15(23)10-27-18-19-13-4-2-3-5-14(13)20-18/h2-9H,10H2,1H3,(H-,19,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3[nH]c4ccccc4n3 | |
| AKOS005250475 | 382.393 | C18 H14 N4 O4 S | ZLCVJRHMJKSXNR-UHFFFAOYSA-N | InChI=1S/C18H14N4O4S/c1-11-3-4-12(9-19)17(20-11)27-10-15(23)16-18(24)26-21-22(16)13-5-7-14(25-2)8-6-13/h3-8H,10H2,1-2H3 | Cc1ccc(c(n1)SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C#N | |
| AKOS005250741 | 382.393 | C18 H14 N4 O4 S | ULNDICFKKFVHQU-UHFFFAOYSA-N | InChI=1S/C18H14N4O4S/c1-22-16(18(24)26-21-22)15(23)10-27-17-12(9-19)5-8-14(20-17)11-3-6-13(25-2)7-4-11/h3-8H,10H2,1-2H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2c(ccc(n2)c3ccc(cc3)OC)C#N | |
| AKOS005251122 | 382.393 | C18 H14 N4 O4 S | ZSRLYSPYGKBSEG-UHFFFAOYSA-N | InChI=1S/C18H14N4O4S/c1-22-17(18(24)26-21-22)27-10-15(23)19-12-8-6-11(7-9-12)16-20-13-4-2-3-5-14(13)25-16/h2-9H,10H2,1H3,(H-,19,20,21,23,24) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2ccc(cc2)c3nc4ccccc4o3 | |
| AKOS005253773 | 382.393 | C18 H14 N4 O4 S | SJEBUOXWWRONKM-UHFFFAOYSA-N | InChI=1S/C18H14N4O4S/c1-9-3-8-12-13(19)16(27-17(12)20-9)15(23)14-18(24)26-21-22(14)10-4-6-11(25-2)7-5-10/h3-8H,1-2H3,(H2-,19,21,23,24) | Cc1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N | |
| AKOS005253834 | 382.393 | C18 H14 N4 O4 S | ZYJSKGYLAFONIF-UHFFFAOYSA-N | InChI=1S/C18H14N4O4S/c1-22-14(18(24)26-21-22)15(23)16-13(19)10-7-8-11(20-17(10)27-16)9-5-3-4-6-12(9)25-2/h3-8H,1-2H3,(H2-,19,21,23,24) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3ccc(nc3s2)c4ccccc4OC)N | |
| AKOS005253875 | 382.393 | C18 H14 N4 O4 S | GCALEBVQECPXGW-UHFFFAOYSA-N | InChI=1S/C18H14N4O4S/c1-22-14(18(24)26-21-22)15(23)16-13(19)11-6-7-12(20-17(11)27-16)9-4-3-5-10(8-9)25-2/h3-8H,1-2H3,(H2-,19,21,23,24) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3ccc(nc3s2)c4cccc(c4)OC)N | |
| AKOS005253905 | 382.393 | C18 H14 N4 O4 S | ZPVXOCJNUVMIRG-UHFFFAOYSA-N | InChI=1S/C18H14N4O4S/c1-22-14(18(24)26-21-22)15(23)16-13(19)11-7-8-12(20-17(11)27-16)9-3-5-10(25-2)6-4-9/h3-8H,1-2H3,(H2-,19,21,23,24) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3ccc(nc3s2)c4ccc(cc4)OC)N | |
| AKOS005253801 | 398.393 | C18 H14 N4 O5 S | MLVILKIOKSQNEL-UHFFFAOYSA-N | InChI=1S/C18H14N4O5S/c1-7-10(8(2)23)11(9-5-4-6-26-9)12-13(19)16(28-17(12)20-7)15(24)14-18(25)27-21-22(14)3/h4-6H,1-3H3,(H2-,19,21,24,25) | Cc1c(c(c2c(c(sc2n1)C(=O)c3c(on[n+]3C)[O-])N)c4ccco4)C(=O)C | |
| AKOS005250412 | 410.407 | C18 H14 N6 O4 S | SAVYKSZYYGHKIB-UHFFFAOYSA-N | InChI=1S/C18H14N6O4S/c1-27-14-9-7-13(8-10-14)23-16(17(26)28-22-23)15(25)11-29-18-19-20-21-24(18)12-5-3-2-4-6-12/h2-10H,11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nnnn3c4ccccc4 | |
| AKOS005253463 | 486.484 | C18 H14 N8 O5 S2 | UXPJZLPALZIOFI-UHFFFAOYSA-N | InChI=1S/C18H14N8O5S2/c1-26-13(18(28)31-25-26)10-9(6-19)15(21)24-17-11(10)12(20)14(32-17)16(27)23-7-2-4-8(5-3-7)33(22,29)30/h2-5H,1H3,(H7-,20,21,22,23,24,25,27,28,29,30) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(cc4)S(=O)(=O)N)N)N)C#N | |
| AKOS005253599 | 486.484 | C18 H14 N8 O5 S2 | XJLWPWIILCPZOV-UHFFFAOYSA-N | InChI=1S/C18H14N8O5S2/c1-26-15(18(28)31-25-26)14-11(6-19)16(21)24-17(12(14)7-20)32-8-13(27)23-9-2-4-10(5-3-9)33(22,29)30/h2-5H,8H2,1H3,(H5-,21,22,23,24,25,27,28,29,30) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(cc3)S(=O)(=O)N)N)C#N | |
| AKOS005251677 | 452.297 | C18 H15 Br F N3 O3 S | CNNLXEZAZVPTGP-UHFFFAOYSA-N | InChI=1S/C18H15BrFN3O3S/c1-2-15(16(24)21-14-9-8-11(19)10-13(14)20)27-17-18(25)26-22-23(17)12-6-4-3-5-7-12/h3-10,15H,2H2,1H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc(cc1F)Br)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251783 | 468.297 | C18 H15 Br F N3 O4 S | OEQMTDNPJIRCOM-UHFFFAOYSA-N | InChI=1S/C18H15BrFN3O4S/c1-10(16(24)21-15-8-3-11(19)9-14(15)20)28-17-18(25)27-22-23(17)12-4-6-13(26-2)7-5-12/h3-10H,1-2H3,(H-,21,22,24,25) | CC(C(=O)Nc1ccc(cc1F)Br)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252200 | 468.297 | C18 H15 Br F N3 O4 S | PJEDCSUMIIJNCI-UHFFFAOYSA-N | InChI=1S/C18H15BrFN3O4S/c1-26-13-5-3-12(4-6-13)23-17(18(25)27-22-23)28-9-8-16(24)21-15-7-2-11(19)10-14(15)20/h2-7,10H,8-9H2,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3F)Br | |
| AKOS005251732 | 407.846 | C18 H15 Cl F N3 O3 S | OJGUZAAHMADWMM-UHFFFAOYSA-N | InChI=1S/C18H15ClFN3O3S/c1-2-15(16(24)21-11-8-9-14(20)13(19)10-11)27-17-18(25)26-22-23(17)12-6-4-3-5-7-12/h3-10,15H,2H2,1H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc(c(c1)Cl)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251787 | 423.846 | C18 H15 Cl F N3 O4 S | YQTMTRRHAWMWCS-UHFFFAOYSA-N | InChI=1S/C18H15ClFN3O4S/c1-10(16(24)21-11-3-8-15(20)14(19)9-11)28-17-18(25)27-22-23(17)12-4-6-13(26-2)7-5-12/h3-10H,1-2H3,(H-,21,22,24,25) | CC(C(=O)Nc1ccc(c(c1)Cl)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252216 | 423.846 | C18 H15 Cl F N3 O4 S | WOEFWHBCMMXMGU-UHFFFAOYSA-N | InChI=1S/C18H15ClFN3O4S/c1-26-13-5-3-12(4-6-13)23-17(18(25)27-22-23)28-9-8-16(24)21-11-2-7-15(20)14(19)10-11/h2-7,10H,8-9H2,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(c(c3)Cl)F | |
| AKOS005252724 | 414.869 | C18 H15 Cl N6 O2 S | MPPMBZXRHZIHRA-UHFFFAOYSA-N | InChI=1S/C18H15ClN6O2S/c1-24(2)25-10-17(27-23-25)22-16(26)11-28-18-13(9-20)5-8-15(21-18)12-3-6-14(19)7-4-12/h3-8,10H,11H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)c3ccc(cc3)Cl)C#N | |
| AKOS005252013 | 424.301 | C18 H15 Cl2 N3 O3 S | DJJVLTZWMQKNND-UHFFFAOYSA-N | InChI=1S/C18H15Cl2N3O3S/c1-2-15(16(24)21-14-9-8-11(19)10-13(14)20)27-17-18(25)26-22-23(17)12-6-4-3-5-7-12/h3-10,15H,2H2,1H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc(cc1Cl)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252016 | 424.301 | C18 H15 Cl2 N3 O3 S | ALLXTVWMPMQUDX-UHFFFAOYSA-N | InChI=1S/C18H15Cl2N3O3S/c1-2-15(16(24)21-13-9-11(19)8-12(20)10-13)27-17-18(25)26-22-23(17)14-6-4-3-5-7-14/h3-10,15H,2H2,1H3,(H-,21,22,24,25) | CCC(C(=O)Nc1cc(cc(c1)Cl)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252118 | 424.301 | C18 H15 Cl2 N3 O3 S | DIRMFJFYJZCCHZ-UHFFFAOYSA-N | InChI=1S/C18H15Cl2N3O3S/c1-2-15(16(24)21-14-10-11(19)8-9-13(14)20)27-17-18(25)26-22-23(17)12-6-4-3-5-7-12/h3-10,15H,2H2,1H3,(H-,21,22,24,25) | CCC(C(=O)Nc1cc(ccc1Cl)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252132 | 424.301 | C18 H15 Cl2 N3 O3 S | VOMKFLJQLNOMJS-UHFFFAOYSA-N | InChI=1S/C18H15Cl2N3O3S/c1-2-14(16(24)21-13-10-6-9-12(19)15(13)20)27-17-18(25)26-22-23(17)11-7-4-3-5-8-11/h3-10,14H,2H2,1H3,(H-,21,22,24,25) | CCC(C(=O)Nc1cccc(c1Cl)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252133 | 424.301 | C18 H15 Cl2 N3 O3 S | YJIPBLCGMOHVJK-UHFFFAOYSA-N | InChI=1S/C18H15Cl2N3O3S/c1-2-15(16(24)21-11-8-9-13(19)14(20)10-11)27-17-18(25)26-22-23(17)12-6-4-3-5-7-12/h3-10,15H,2H2,1H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc(c(c1)Cl)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250269 | 408.235 | C18 H15 Cl2 N3 O4 | YMFCUCLHVFZOPI-UHFFFAOYSA-N | InChI=1S/C18H15Cl2N3O4/c1-22(17(24)14-8-3-11(19)9-15(14)20)10-16-18(25)27-21-23(16)12-4-6-13(26-2)7-5-12/h3-9H,10H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)c3ccc(cc3Cl)Cl | |
| AKOS005250631 | 408.235 | C18 H15 Cl2 N3 O4 | QVOGVXBYPDPIBP-UHFFFAOYSA-N | InChI=1S/C18H15Cl2N3O4/c1-26-14-6-4-13(5-7-14)23-16(18(25)27-22-23)17(24)21-9-8-11-2-3-12(19)10-15(11)20/h2-7,10H,8-9H2,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCCc3ccc(cc3Cl)Cl | |
| AKOS005251791 | 440.3 | C18 H15 Cl2 N3 O4 S | ALJCQVYSXBQVGX-UHFFFAOYSA-N | InChI=1S/C18H15Cl2N3O4S/c1-10(16(24)21-14-5-3-4-13(19)15(14)20)28-17-18(25)27-22-23(17)11-6-8-12(26-2)9-7-11/h3-10H,1-2H3,(H-,21,22,24,25) | CC(C(=O)Nc1cccc(c1Cl)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251794 | 440.3 | C18 H15 Cl2 N3 O4 S | GEJCVINQXJEYPJ-UHFFFAOYSA-N | InChI=1S/C18H15Cl2N3O4S/c1-10(16(24)21-15-8-3-11(19)9-14(15)20)28-17-18(25)27-22-23(17)12-4-6-13(26-2)7-5-12/h3-10H,1-2H3,(H-,21,22,24,25) | CC(C(=O)Nc1ccc(cc1Cl)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251795 | 440.3 | C18 H15 Cl2 N3 O4 S | JAPAZAHTXBWPBF-UHFFFAOYSA-N | InChI=1S/C18H15Cl2N3O4S/c1-10(16(24)21-15-9-11(19)3-8-14(15)20)28-17-18(25)27-22-23(17)12-4-6-13(26-2)7-5-12/h3-10H,1-2H3,(H-,21,22,24,25) | CC(C(=O)Nc1cc(ccc1Cl)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251802 | 440.3 | C18 H15 Cl2 N3 O4 S | OHLMTMFTOHOCKY-UHFFFAOYSA-N | InChI=1S/C18H15Cl2N3O4S/c1-10(16(24)21-11-3-8-14(19)15(20)9-11)28-17-18(25)27-22-23(17)12-4-6-13(26-2)7-5-12/h3-10H,1-2H3,(H-,21,22,24,25) | CC(C(=O)Nc1ccc(c(c1)Cl)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251803 | 440.3 | C18 H15 Cl2 N3 O4 S | DNTABUJFYOUBLL-UHFFFAOYSA-N | InChI=1S/C18H15Cl2N3O4S/c1-10(16(24)21-13-8-11(19)7-12(20)9-13)28-17-18(25)27-22-23(17)14-3-5-15(26-2)6-4-14/h3-10H,1-2H3,(H-,21,22,24,25) | CC(C(=O)Nc1cc(cc(c1)Cl)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252169 | 440.3 | C18 H15 Cl2 N3 O4 S | DZKMNHWNRZFXAI-UHFFFAOYSA-N | InChI=1S/C18H15Cl2N3O4S/c1-26-13-5-3-12(4-6-13)23-17(18(25)27-22-23)28-9-8-16(24)21-11-2-7-14(19)15(20)10-11/h2-7,10H,8-9H2,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(c(c3)Cl)Cl | |
| AKOS005252170 | 440.3 | C18 H15 Cl2 N3 O4 S | CDAZNVOPYTWEFE-UHFFFAOYSA-N | InChI=1S/C18H15Cl2N3O4S/c1-26-15-4-2-14(3-5-15)23-17(18(25)27-22-23)28-7-6-16(24)21-13-9-11(19)8-12(20)10-13/h2-5,8-10H,6-7H2,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cc(cc(c3)Cl)Cl | |
| AKOS005252232 | 440.3 | C18 H15 Cl2 N3 O4 S | TUCDRWIODMKUJA-UHFFFAOYSA-N | InChI=1S/C18H15Cl2N3O4S/c1-26-12-7-5-11(6-8-12)23-17(18(25)27-22-23)28-10-9-15(24)21-14-4-2-3-13(19)16(14)20/h2-8H,9-10H2,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cccc(c3Cl)Cl | |
| AKOS005252239 | 440.3 | C18 H15 Cl2 N3 O4 S | ONMLWLNFOIIURW-UHFFFAOYSA-N | InChI=1S/C18H15Cl2N3O4S/c1-26-13-5-3-12(4-6-13)23-17(18(25)27-22-23)28-9-8-16(24)21-15-7-2-11(19)10-14(15)20/h2-7,10H,8-9H2,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3Cl)Cl | |
| AKOS005252240 | 440.3 | C18 H15 Cl2 N3 O4 S | XJRYZNLMGFGFTG-UHFFFAOYSA-N | InChI=1S/C18H15Cl2N3O4S/c1-26-13-5-3-12(4-6-13)23-17(18(25)27-22-23)28-9-8-16(24)21-15-10-11(19)2-7-14(15)20/h2-7,10H,8-9H2,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cc(ccc3Cl)Cl | |
| AKOS005251920 | 391.392 | C18 H15 F2 N3 O3 S | XJIRVHZIRZILNW-UHFFFAOYSA-N | InChI=1S/C18H15F2N3O3S/c1-2-15(16(24)21-11-8-9-13(19)14(20)10-11)27-17-18(25)26-22-23(17)12-6-4-3-5-7-12/h3-10,15H,2H2,1H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc(c(c1)F)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251800 | 407.391 | C18 H15 F2 N3 O4 S | DSKLUZGJWPEWEU-UHFFFAOYSA-N | InChI=1S/C18H15F2N3O4S/c1-10(16(24)21-11-3-8-14(19)15(20)9-11)28-17-18(25)27-22-23(17)12-4-6-13(26-2)7-5-12/h3-10H,1-2H3,(H-,21,22,24,25) | CC(C(=O)Nc1ccc(c(c1)F)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252649 | 407.391 | C18 H15 F2 N3 O4 S | IMGVOQORPQUHJH-UHFFFAOYSA-N | InChI=1S/C18H15F2N3O4S/c1-26-13-5-3-12(4-6-13)23-17(18(25)27-22-23)28-9-8-16(24)21-11-2-7-14(19)15(20)10-11/h2-7,10H,8-9H2,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(c(c3)F)F | |
| AKOS005250399 | 321.33 | C18 H15 N3 O3 | RMKYPJDNCSAPML-UHFFFAOYSA-N | InChI=1S/C18H15N3O3/c1-20-16(18(23)24-19-20)17(22)21-14-8-4-2-6-12(14)10-11-13-7-3-5-9-15(13)21/h2-9H,10-11H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)N2c3ccccc3CCc4c2cccc4 | |
| AKOS005250491 | 321.33 | C18 H15 N3 O3 | KREAMXSKQFHZRM-UHFFFAOYSA-N | InChI=1S/C18H15N3O3/c22-17(20-11-10-13-6-4-5-7-14(13)12-20)16-18(23)24-19-21(16)15-8-2-1-3-9-15/h1-9H,10-12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCc4ccccc4C3 | |
| AKOS005251160 | 369.394 | C18 H15 N3 O4 S | QVJPQUOVLCJNQU-UHFFFAOYSA-N | InChI=1S/C18H15N3O4S/c1-12(22)13-7-9-14(10-8-13)19-16(23)11-26-17-18(24)25-20-21(17)15-5-3-2-4-6-15/h2-10H,11H2,1H3,(H-,19,20,22,23,24) | CC(=O)c1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250123 | 353.329 | C18 H15 N3 O5 | SPSHGHWFJPNMTB-UHFFFAOYSA-N | InChI=1S/C18H15N3O5/c1-11(22)12-3-5-13(6-4-12)19-17(23)16-18(24)26-20-21(16)14-7-9-15(25-2)10-8-14/h3-10H,1-2H3,(H-,19,20,22,23,24) | CC(=O)c1ccc(cc1)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251139 | 385.394 | C18 H15 N3 O5 S | IBHJMFFBLWUFCT-UHFFFAOYSA-N | InChI=1S/C18H15N3O5S/c1-11-7-8-12(17(23)24)9-14(11)19-15(22)10-27-16-18(25)26-20-21(16)13-5-3-2-4-6-13/h2-9H,10H2,1H3,(H2-,19,20,22,23,24,25) | Cc1ccc(cc1NC(=O)CSc2c(on[n+]2c3ccccc3)[O-])C(=O)O | |
| AKOS005251145 | 385.394 | C18 H15 N3 O5 S | SIJNZBDMLWZLPB-UHFFFAOYSA-N | InChI=1S/C18H15N3O5S/c1-25-17(23)13-9-5-6-10-14(13)19-15(22)11-27-16-18(24)26-20-21(16)12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H-,19,20,22,23,24) | COC(=O)c1ccccc1NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251188 | 385.394 | C18 H15 N3 O5 S | WAFGHEIYBNITCE-UHFFFAOYSA-N | InChI=1S/C18H15N3O5S/c22-16(19-12-6-7-14-15(10-12)25-9-8-24-14)11-27-17-18(23)26-20-21(17)13-4-2-1-3-5-13/h1-7,10H,8-9,11H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc4c(c3)OCCO4 | |
| AKOS005251771 | 385.394 | C18 H15 N3 O5 S | WBAAAJSCHXEODK-UHFFFAOYSA-N | InChI=1S/C18H15N3O5S/c1-11(16(22)19-12-7-8-14-15(9-12)25-10-24-14)27-17-18(23)26-20-21(17)13-5-3-2-4-6-13/h2-9,11H,10H2,1H3,(H-,19,20,22,23) | CC(C(=O)Nc1ccc2c(c1)OCO2)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251870 | 385.394 | C18 H15 N3 O5 S | OLKWVJFPKZEVLN-UHFFFAOYSA-N | InChI=1S/C18H15N3O5S/c1-11(15(22)19-13-9-7-12(8-10-13)17(23)24)27-16-18(25)26-20-21(16)14-5-3-2-4-6-14/h2-11H,1H3,(H2-,19,20,22,23,24,25) | CC(C(=O)Nc1ccc(cc1)C(=O)O)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251871 | 385.394 | C18 H15 N3 O5 S | OORRIONSNHUBRR-UHFFFAOYSA-N | InChI=1S/C18H15N3O5S/c1-11(15(22)19-13-7-5-6-12(10-13)17(23)24)27-16-18(25)26-20-21(16)14-8-3-2-4-9-14/h2-11H,1H3,(H2-,19,20,22,23,24,25) | CC(C(=O)Nc1cccc(c1)C(=O)O)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252147 | 385.394 | C18 H15 N3 O5 S | VCJDQHVSSNTFLY-UHFFFAOYSA-N | InChI=1S/C18H15N3O5S/c22-15(19-13-8-6-12(7-9-13)17(23)24)10-11-27-16-18(25)26-20-21(16)14-4-2-1-3-5-14/h1-9H,10-11H2,(H2-,19,20,22,23,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)C(=O)O | |
| AKOS005252148 | 385.394 | C18 H15 N3 O5 S | HQRLORXMLMFGFB-UHFFFAOYSA-N | InChI=1S/C18H15N3O5S/c22-15(19-13-6-4-5-12(11-13)17(23)24)9-10-27-16-18(25)26-20-21(16)14-7-2-1-3-8-14/h1-8,11H,9-10H2,(H2-,19,20,22,23,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cccc(c3)C(=O)O | |
| AKOS005252162 | 385.394 | C18 H15 N3 O5 S | CCOXNURIJPBVJF-UHFFFAOYSA-N | InChI=1S/C18H15N3O5S/c22-16(19-12-6-7-14-15(10-12)25-11-24-14)8-9-27-17-18(23)26-20-21(17)13-4-2-1-3-5-13/h1-7,10H,8-9,11H2,(H-,19,20,22,23) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc4c(c3)OCO4 | |
| AKOS005250138 | 369.328 | C18 H15 N3 O6 | FUDMAPDTRAXSFQ-UHFFFAOYSA-N | InChI=1S/C18H15N3O6/c1-25-12-9-7-11(8-10-12)21-15(18(24)27-20-21)16(22)19-14-6-4-3-5-13(14)17(23)26-2/h3-10H,1-2H3,(H-,19,20,22,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccccc3C(=O)OC | |
| AKOS005250146 | 369.328 | C18 H15 N3 O6 | NHZAJHUWVVMQSV-UHFFFAOYSA-N | InChI=1S/C18H15N3O6/c1-24-13-5-3-12(4-6-13)21-16(18(23)27-20-21)17(22)19-11-2-7-14-15(10-11)26-9-8-25-14/h2-7,10H,8-9H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc4c(c3)OCCO4 | |
| AKOS005250206 | 369.328 | C18 H15 N3 O6 | YCCLSHCEOLWFAC-UHFFFAOYSA-N | InChI=1S/C18H15N3O6/c1-24-13-5-3-12(4-6-13)21-16(18(23)27-20-21)17(22)19-9-11-2-7-14-15(8-11)26-10-25-14/h2-8H,9-10H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCc3ccc4c(c3)OCO4 | |
| AKOS005250208 | 369.328 | C18 H15 N3 O6 | MCODJFWMYNKQPY-UHFFFAOYSA-N | InChI=1S/C18H15N3O6/c1-10-3-4-11(17(23)24)9-14(10)19-16(22)15-18(25)27-20-21(15)12-5-7-13(26-2)8-6-12/h3-9H,1-2H3,(H2-,19,20,22,23,24,25) | Cc1ccc(cc1NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C(=O)O | |
| AKOS005251203 | 401.393 | C18 H15 N3 O6 S | OPDSAWDZPGKQKW-UHFFFAOYSA-N | InChI=1S/C18H15N3O6S/c1-26-14-9-11(17(23)24)7-8-13(14)19-15(22)10-28-16-18(25)27-20-21(16)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H2-,19,20,22,23,24,25) | COc1cc(ccc1NC(=O)CSc2c(on[n+]2c3ccccc3)[O-])C(=O)O | |
| AKOS005251551 | 401.393 | C18 H15 N3 O6 S | DFGWGERJBJCXOG-UHFFFAOYSA-N | InChI=1S/C18H15N3O6S/c1-26-14-8-6-13(7-9-14)21-16(18(25)27-20-21)28-10-15(22)19-12-4-2-11(3-5-12)17(23)24/h2-9H,10H2,1H3,(H2-,19,20,22,23,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)C(=O)O | |
| AKOS005251552 | 401.393 | C18 H15 N3 O6 S | QTEFUADULQKOAN-UHFFFAOYSA-N | InChI=1S/C18H15N3O6S/c1-26-14-7-5-13(6-8-14)21-16(18(25)27-20-21)28-10-15(22)19-12-4-2-3-11(9-12)17(23)24/h2-9H,10H2,1H3,(H2-,19,20,22,23,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cccc(c3)C(=O)O | |
| AKOS005251598 | 401.393 | C18 H15 N3 O6 S | PMHMZGYRMUZYLH-UHFFFAOYSA-N | InChI=1S/C18H15N3O6S/c1-24-13-5-3-12(4-6-13)21-17(18(23)27-20-21)28-9-16(22)19-11-2-7-14-15(8-11)26-10-25-14/h2-8H,9-10H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc4c(c3)OCO4 | |
| AKOS005251881 | 401.393 | C18 H15 N3 O6 S | ZLUMLUGKZLOJRZ-UHFFFAOYSA-N | InChI=1S/C18H15N3O6S/c1-10(15(23)19-11-7-8-14(22)13(9-11)17(24)25)28-16-18(26)27-20-21(16)12-5-3-2-4-6-12/h2-10,20H,1H3,(H2,24,25,26) | CC(C(=O)Nc1ccc(c(c1)C(=O)O)O)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252158 | 401.393 | C18 H15 N3 O6 S | CNBLNYOHHQWTBN-UHFFFAOYSA-N | InChI=1S/C18H15N3O6S/c22-14-7-6-11(10-13(14)17(24)25)19-15(23)8-9-28-16-18(26)27-20-21(16)12-4-2-1-3-5-12/h1-7,10,20H,8-9H2,(H2,24,25,26) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(c(c3)C(=O)O)O | |
| AKOS005250177 | 385.328 | C18 H15 N3 O7 | ZORIXRCHJNFFHN-UHFFFAOYSA-N | InChI=1S/C18H15N3O7/c1-26-12-6-4-11(5-7-12)21-15(18(25)28-20-21)16(22)19-13-8-3-10(17(23)24)9-14(13)27-2/h3-9H,1-2H3,(H2-,19,20,22,23,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(cc3OC)C(=O)O | |
| AKOS005251582 | 417.393 | C18 H15 N3 O7 S | VIJPFHILDCKSFN-UHFFFAOYSA-N | InChI=1S/C18H15N3O7S/c1-27-12-5-3-11(4-6-12)21-16(18(26)28-20-21)29-9-15(23)19-10-2-7-14(22)13(8-10)17(24)25/h2-8,20H,9H2,1H3,(H2,24,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(c(c3)C(=O)O)O | |
| AKOS005252022 | 399.4 | C18 H15 N4 O5 S | KLGZOQCYJAWLRK-UHFFFAOYSA-M | InChI=1S/C18H16N4O5S/c1-2-15(16(23)19-12-8-10-14(11-9-12)22(25)26)28-17-18(24)27-20-21(17)13-6-4-3-5-7-13/h3-8,10-11,15,24H,2H2,1H3,(H,19,23)/p-1 | CCC(C(=O)Nc1ccc(c[c-]1)[N+](=O)[O-])Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251827 | 415.4 | C18 H15 N4 O6 S | JPMNWMSFVQYYGJ-UHFFFAOYSA-M | InChI=1S/C18H16N4O6S/c1-11(16(23)19-12-3-5-14(6-4-12)22(25)26)29-17-18(24)28-20-21(17)13-7-9-15(27-2)10-8-13/h3,5-11,24H,1-2H3,(H,19,23)/p-1 | CC(C(=O)Nc1ccc(c[c-]1)[N+](=O)[O-])Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252194 | 415.4 | C18 H15 N4 O6 S | LWLDCZMNDPGNLN-UHFFFAOYSA-M | InChI=1S/C18H16N4O6S/c1-27-15-8-6-13(7-9-15)21-17(18(24)28-20-21)29-11-10-16(23)19-12-2-4-14(5-3-12)22(25)26/h2,4-9,24H,10-11H2,1H3,(H,19,23)/p-1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(c[c-]3)[N+](=O)[O-] | |
| AKOS005252482 | 365.409 | C18 H15 N5 O2 S | UAMAEQWLHJTYQN-UHFFFAOYSA-N | InChI=1S/C18H15N5O2S/c1-2-23-11-17(25-22-23)21-16(24)12-26-18-14(10-19)8-9-15(20-18)13-6-4-3-5-7-13/h3-9,11H,2,12H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)c3ccccc3)C#N | |
| AKOS005252524 | 365.409 | C18 H15 N5 O2 S | QXWHOOVCIVGKIU-UHFFFAOYSA-N | InChI=1S/C18H15N5O2S/c1-12-3-5-13(6-4-12)15-8-7-14(9-19)18(20-15)26-11-16(24)21-17-10-23(2)22-25-17/h3-8,10H,11H2,1-2H3 | Cc1ccc(cc1)c2ccc(c(n2)SCC(=O)[N-]c3c[n+](no3)C)C#N | |
| AKOS005252523 | 381.408 | C18 H15 N5 O3 S | ODCRERZWNNVWHR-UHFFFAOYSA-N | InChI=1S/C18H15N5O3S/c1-23-10-17(26-22-23)21-16(24)11-27-18-13(9-19)5-8-15(20-18)12-3-6-14(25-2)7-4-12/h3-8,10H,11H2,1-2H3 | C[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)c3ccc(cc3)OC)C#N | |
| AKOS005251594 | 429.473 | C18 H15 N5 O4 S2 | KIPHSMUUMAVLBR-UHFFFAOYSA-N | InChI=1S/C18H15N5O4S2/c1-10-12(8-19)16(21-13(24)9-28-17-18(26)27-22-23(17)2)29-14(10)15(25)20-11-6-4-3-5-7-11/h3-7H,9H2,1-2H3,(H2-,20,21,22,24,25,26) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)CSc3c(on[n+]3C)[O-])C#N | |
| AKOS005252896 | 425.487 | C18 H15 N7 O2 S2 | NCXZHIJBSHJXTR-UHFFFAOYSA-N | InChI=1S/C18H15N7O2S2/c1-10(2)25-8-15(27-24-25)22-14(26)9-29-18-12(7-20)16(13-4-3-5-28-13)11(6-19)17(21)23-18/h3-5,8,10H,9H2,1-2H3,(H2-,21,22,23,24,26) | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3cccs3)C#N | |
| AKOS005252903 | 409.422 | C18 H15 N7 O3 S | YEQYDQXFKVGHSL-UHFFFAOYSA-N | InChI=1S/C18H15N7O3S/c1-10(2)25-8-15(28-24-25)22-14(26)9-29-18-12(7-20)16(13-4-3-5-27-13)11(6-19)17(21)23-18/h3-5,8,10H,9H2,1-2H3,(H2-,21,22,23,24,26) | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3ccco3)C#N | |
| AKOS005253334 | 441.487 | C18 H15 N7 O3 S2 | BVFXKZFRVUCHBK-UHFFFAOYSA-N | InChI=1S/C18H15N7O3S2/c1-27-5-4-25-9-15(28-24-25)22-14(26)10-30-18-12(8-20)16(13-3-2-6-29-13)11(7-19)17(21)23-18/h2-3,6,9H,4-5,10H2,1H3,(H2-,21,22,23,24,26) | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3cccs3)C#N | |
| AKOS005253341 | 425.421 | C18 H15 N7 O4 S | ORLFZJBKMKQLLR-UHFFFAOYSA-N | InChI=1S/C18H15N7O4S/c1-27-6-4-25-9-15(29-24-25)22-14(26)10-30-18-12(8-20)16(13-3-2-5-28-13)11(7-19)17(21)23-18/h2-3,5,9H,4,6,10H2,1H3,(H2-,21,22,23,24,26) | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3ccco3)C#N | |
| AKOS005251724 | 434.307 | C18 H16 Br N3 O3 S | HHPYSVUOCAPFIS-UHFFFAOYSA-N | InChI=1S/C18H16BrN3O3S/c1-2-15(16(23)20-14-11-7-6-10-13(14)19)26-17-18(24)25-21-22(17)12-8-4-3-5-9-12/h3-11,15H,2H2,1H3,(H-,20,21,23,24) | CCC(C(=O)Nc1ccccc1Br)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251735 | 434.307 | C18 H16 Br N3 O3 S | AVVNIHQWKXDULW-UHFFFAOYSA-N | InChI=1S/C18H16BrN3O3S/c1-2-15(16(23)20-13-10-8-12(19)9-11-13)26-17-18(24)25-21-22(17)14-6-4-3-5-7-14/h3-11,15H,2H2,1H3,(H-,20,21,23,24) | CCC(C(=O)Nc1ccc(cc1)Br)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251781 | 450.306 | C18 H16 Br N3 O4 S | ZNNGATANFDRDKR-UHFFFAOYSA-N | InChI=1S/C18H16BrN3O4S/c1-11(16(23)20-15-6-4-3-5-14(15)19)27-17-18(24)26-21-22(17)12-7-9-13(25-2)10-8-12/h3-11H,1-2H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccccc1Br)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251782 | 450.306 | C18 H16 Br N3 O4 S | PZRXHDWYCYTLJO-UHFFFAOYSA-N | InChI=1S/C18H16BrN3O4S/c1-11(16(23)20-13-5-3-12(19)4-6-13)27-17-18(24)26-21-22(17)14-7-9-15(25-2)10-8-14/h3-11H,1-2H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccc(cc1)Br)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252192 | 450.306 | C18 H16 Br N3 O4 S | GMKBYXBNRNWJKF-UHFFFAOYSA-N | InChI=1S/C18H16BrN3O4S/c1-25-13-8-6-12(7-9-13)22-17(18(24)26-21-22)27-11-10-16(23)20-15-5-3-2-4-14(15)19/h2-9H,10-11H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccccc3Br | |
| AKOS005252199 | 450.306 | C18 H16 Br N3 O4 S | RJFYSOGTRJFFDT-UHFFFAOYSA-N | InChI=1S/C18H16BrN3O4S/c1-25-15-8-6-14(7-9-15)22-17(18(24)26-21-22)27-11-10-16(23)20-13-4-2-12(19)3-5-13/h2-9H,10-11H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)Br | |
| AKOS005219488 | 357.791 | C18 H16 Cl N3 O3 | VFMSOPIEPGBIQT-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O3/c1-21(17(23)11-13-7-9-14(19)10-8-13)12-16-18(24)25-20-22(16)15-5-3-2-4-6-15/h2-10H,11-12H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)Cc3ccc(cc3)Cl | |
| AKOS005251469 | 389.856 | C18 H16 Cl N3 O3 S | MZZMVTQUZDWHAH-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O3S/c1-11-14(19)9-6-10-15(11)20-16(23)12(2)26-17-18(24)25-21-22(17)13-7-4-3-5-8-13/h3-10,12H,1-2H3,(H-,20,21,23,24) | Cc1c(cccc1Cl)NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251470 | 389.856 | C18 H16 Cl N3 O3 S | OQFOEEHFELLCHP-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O3S/c1-11-8-9-13(10-15(11)19)20-16(23)12(2)26-17-18(24)25-21-22(17)14-6-4-3-5-7-14/h3-10,12H,1-2H3,(H-,20,21,23,24) | Cc1ccc(cc1Cl)NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251478 | 389.856 | C18 H16 Cl N3 O3 S | QRSXGVWYWXVSTK-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O3S/c1-11-8-9-13(19)10-15(11)20-16(23)12(2)26-17-18(24)25-21-22(17)14-6-4-3-5-7-14/h3-10,12H,1-2H3,(H-,20,21,23,24) | Cc1ccc(cc1NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-])Cl | |
| AKOS005251710 | 389.856 | C18 H16 Cl N3 O3 S | UEUTXERWNDEHMQ-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O3S/c1-2-15(16(23)20-13-10-8-12(19)9-11-13)26-17-18(24)25-21-22(17)14-6-4-3-5-7-14/h3-11,15H,2H2,1H3,(H-,20,21,23,24) | CCC(C(=O)Nc1ccc(cc1)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251718 | 389.856 | C18 H16 Cl N3 O3 S | YCFVOAJFJQOTRF-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O3S/c1-2-15(16(23)20-14-11-7-6-10-13(14)19)26-17-18(24)25-21-22(17)12-8-4-3-5-9-12/h3-11,15H,2H2,1H3,(H-,20,21,23,24) | CCC(C(=O)Nc1ccccc1Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251738 | 389.856 | C18 H16 Cl N3 O3 S | ZIIPGSRMCVWMTC-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O3S/c1-2-15(16(23)20-13-8-6-7-12(19)11-13)26-17-18(24)25-21-22(17)14-9-4-3-5-10-14/h3-11,15H,2H2,1H3,(H-,20,21,23,24) | CCC(C(=O)Nc1cccc(c1)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252324 | 389.856 | C18 H16 Cl N3 O3 S | WIUVXVBNCSUYIX-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O3S/c1-12-14(19)8-5-9-15(12)20-16(23)10-11-26-17-18(24)25-21-22(17)13-6-3-2-4-7-13/h2-9H,10-11H2,1H3,(H-,20,21,23,24) | Cc1c(cccc1Cl)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252325 | 389.856 | C18 H16 Cl N3 O3 S | YUKGEQYQLFDPII-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O3S/c1-12-7-8-13(11-15(12)19)20-16(23)9-10-26-17-18(24)25-21-22(17)14-5-3-2-4-6-14/h2-8,11H,9-10H2,1H3,(H-,20,21,23,24) | Cc1ccc(cc1Cl)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252356 | 389.856 | C18 H16 Cl N3 O3 S | VOFZYMFNPWDMPW-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O3S/c1-12-7-8-13(19)11-15(12)20-16(23)9-10-26-17-18(24)25-21-22(17)14-5-3-2-4-6-14/h2-8,11H,9-10H2,1H3,(H-,20,21,23,24) | Cc1ccc(cc1NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-])Cl | |
| AKOS005250189 | 373.79 | C18 H16 Cl N3 O4 | RYQSAHWQNWMQNN-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4/c1-25-15-7-5-14(6-8-15)22-16(18(24)26-21-22)17(23)20-10-9-12-3-2-4-13(19)11-12/h2-8,11H,9-10H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCCc3cccc(c3)Cl | |
| AKOS005250286 | 373.79 | C18 H16 Cl N3 O4 | HUFFKRISBHUAOZ-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4/c1-21(17(23)12-4-3-5-13(19)10-12)11-16-18(24)26-20-22(16)14-6-8-15(25-2)9-7-14/h3-10H,11H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)c3cccc(c3)Cl | |
| AKOS005250503 | 373.79 | C18 H16 Cl N3 O4 | UEPOCQSTYTWSMZ-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4/c1-25-14-8-6-13(7-9-14)22-16(18(24)26-21-22)17(23)20-11-10-12-4-2-3-5-15(12)19/h2-9H,10-11H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCCc3ccccc3Cl | |
| AKOS005250504 | 373.79 | C18 H16 Cl N3 O4 | LQDMYKBNZACVHA-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4/c1-25-15-8-6-14(7-9-15)22-16(18(24)26-21-22)17(23)20-11-10-12-2-4-13(19)5-3-12/h2-9H,10-11H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCCc3ccc(cc3)Cl | |
| AKOS005251151 | 405.855 | C18 H16 Cl N3 O4 S | ULYVUIHUVDOWCS-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4S/c1-11-8-14(15(25-2)9-13(11)19)20-16(23)10-27-17-18(24)26-21-22(17)12-6-4-3-5-7-12/h3-9H,10H2,1-2H3,(H-,20,21,23,24) | Cc1cc(c(cc1Cl)OC)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251638 | 405.855 | C18 H16 Cl N3 O4 S | FKEXLMSHWRAHBU-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4S/c1-11-14(19)4-3-5-15(11)20-16(23)10-27-17-18(24)26-21-22(17)12-6-8-13(25-2)9-7-12/h3-9H,10H2,1-2H3,(H-,20,21,23,24) | Cc1c(cccc1Cl)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251645 | 405.855 | C18 H16 Cl N3 O4 S | HFLIDKTYCYHWMP-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4S/c1-11-3-4-12(9-15(11)19)20-16(23)10-27-17-18(24)26-21-22(17)13-5-7-14(25-2)8-6-13/h3-9H,10H2,1-2H3,(H-,20,21,23,24) | Cc1ccc(cc1Cl)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251646 | 405.855 | C18 H16 Cl N3 O4 S | ZJJZCDPUCDSVLY-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4S/c1-11-3-4-12(19)9-15(11)20-16(23)10-27-17-18(24)26-21-22(17)13-5-7-14(25-2)8-6-13/h3-9H,10H2,1-2H3,(H-,20,21,23,24) | Cc1ccc(cc1NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-])Cl | |
| AKOS005251784 | 405.855 | C18 H16 Cl N3 O4 S | IWVQALLMBJYFTC-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4S/c1-11(16(23)20-15-6-4-3-5-14(15)19)27-17-18(24)26-21-22(17)12-7-9-13(25-2)10-8-12/h3-11H,1-2H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccccc1Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251785 | 405.855 | C18 H16 Cl N3 O4 S | IYHCNBQVFNFURS-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4S/c1-11(16(23)20-13-5-3-4-12(19)10-13)27-17-18(24)26-21-22(17)14-6-8-15(25-2)9-7-14/h3-11H,1-2H3,(H-,20,21,23,24) | CC(C(=O)Nc1cccc(c1)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251786 | 405.855 | C18 H16 Cl N3 O4 S | CRRUPEUBZBXUCG-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4S/c1-11(16(23)20-13-5-3-12(19)4-6-13)27-17-18(24)26-21-22(17)14-7-9-15(25-2)10-8-14/h3-11H,1-2H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccc(cc1)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251878 | 405.855 | C18 H16 Cl N3 O4 S | GFQUHBRPEYKFEL-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4S/c1-11(16(23)20-12-8-9-15(25-2)14(19)10-12)27-17-18(24)26-21-22(17)13-6-4-3-5-7-13/h3-11H,1-2H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccc(c(c1)Cl)OC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251879 | 405.855 | C18 H16 Cl N3 O4 S | MGTQVQXHPQHKDX-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4S/c1-11(16(23)20-14-10-12(19)8-9-15(14)25-2)27-17-18(24)26-21-22(17)13-6-4-3-5-7-13/h3-11H,1-2H3,(H-,20,21,23,24) | CC(C(=O)Nc1cc(ccc1OC)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252149 | 405.855 | C18 H16 Cl N3 O4 S | FQENRQMFXQGYNE-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4S/c1-25-15-8-7-12(11-14(15)19)20-16(23)9-10-27-17-18(24)26-21-22(17)13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1Cl)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252150 | 405.855 | C18 H16 Cl N3 O4 S | PDFUNMUCPYFPIH-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4S/c1-25-15-8-7-12(19)11-14(15)20-16(23)9-10-27-17-18(24)26-21-22(17)13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-])Cl | |
| AKOS005252207 | 405.855 | C18 H16 Cl N3 O4 S | HFPHEXRKWKWLAQ-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4S/c1-25-13-8-6-12(7-9-13)22-17(18(24)26-21-22)27-11-10-16(23)20-15-5-3-2-4-14(15)19/h2-9H,10-11H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccccc3Cl | |
| AKOS005252208 | 405.855 | C18 H16 Cl N3 O4 S | KHOKRVDYCMSIHF-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4S/c1-25-15-7-5-14(6-8-15)22-17(18(24)26-21-22)27-10-9-16(23)20-13-4-2-3-12(19)11-13/h2-8,11H,9-10H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cccc(c3)Cl | |
| AKOS005252215 | 405.855 | C18 H16 Cl N3 O4 S | CSODRBQWVRLSBU-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O4S/c1-25-15-8-6-14(7-9-15)22-17(18(24)26-21-22)27-11-10-16(23)20-13-4-2-12(19)3-5-13/h2-9H,10-11H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)Cl | |
| AKOS005250234 | 389.79 | C18 H16 Cl N3 O5 | LUAFMDWALOLYRQ-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O5/c1-10-8-14(15(26-3)9-13(10)19)20-17(23)16-18(24)27-21-22(16)11-4-6-12(25-2)7-5-11/h4-9H,1-3H3,(H-,20,21,23,24) | Cc1cc(c(cc1Cl)OC)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251167 | 421.855 | C18 H16 Cl N3 O5 S | UMWQATVYSKIAEA-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O5S/c1-25-14-9-15(26-2)13(8-12(14)19)20-16(23)10-28-17-18(24)27-21-22(17)11-6-4-3-5-7-11/h3-9H,10H2,1-2H3,(H-,20,21,23,24) | COc1cc(c(cc1NC(=O)CSc2c(on[n+]2c3ccccc3)[O-])Cl)OC | |
| AKOS005251553 | 421.855 | C18 H16 Cl N3 O5 S | VRJRRUYXMPGTEF-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O5S/c1-25-13-6-4-12(5-7-13)22-17(18(24)27-21-22)28-10-16(23)20-11-3-8-15(26-2)14(19)9-11/h3-9H,10H2,1-2H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(c(c3)Cl)OC | |
| AKOS005251554 | 421.855 | C18 H16 Cl N3 O5 S | SGMNQWIVOQTOQF-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O5S/c1-25-13-6-4-12(5-7-13)22-17(18(24)27-21-22)28-10-16(23)20-14-9-11(19)3-8-15(14)26-2/h3-9H,10H2,1-2H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cc(ccc3OC)Cl | |
| AKOS005250124 | 405.789 | C18 H16 Cl N3 O6 | XWVNRCCJZNDJED-UHFFFAOYSA-N | InChI=1S/C18H16ClN3O6/c1-25-11-6-4-10(5-7-11)22-16(18(24)28-21-22)17(23)20-13-8-12(19)14(26-2)9-15(13)27-3/h4-9H,1-3H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3cc(c(cc3OC)OC)Cl | |
| AKOS005252079 | 373.401 | C18 H16 F N3 O3 S | WBUNKKQPAGGUAU-UHFFFAOYSA-N | InChI=1S/C18H16FN3O3S/c1-2-15(16(23)20-14-11-7-6-10-13(14)19)26-17-18(24)25-21-22(17)12-8-4-3-5-9-12/h3-11,15H,2H2,1H3,(H-,20,21,23,24) | CCC(C(=O)Nc1ccccc1F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252088 | 373.401 | C18 H16 F N3 O3 S | OZMKTOKLNMTOKX-UHFFFAOYSA-N | InChI=1S/C18H16FN3O3S/c1-2-15(16(23)20-13-10-8-12(19)9-11-13)26-17-18(24)25-21-22(17)14-6-4-3-5-7-14/h3-11,15H,2H2,1H3,(H-,20,21,23,24) | CCC(C(=O)Nc1ccc(cc1)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250275 | 357.336 | C18 H16 F N3 O4 | LNRDJYZURDXWPO-UHFFFAOYSA-N | InChI=1S/C18H16FN3O4/c1-21(17(23)14-5-3-4-6-15(14)19)11-16-18(24)26-20-22(16)12-7-9-13(25-2)10-8-12/h3-10H,11H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)c3ccccc3F | |
| AKOS005250278 | 357.336 | C18 H16 F N3 O4 | ZCOXWTDOXJNZHF-UHFFFAOYSA-N | InChI=1S/C18H16FN3O4/c1-21(17(23)12-3-5-13(19)6-4-12)11-16-18(24)26-20-22(16)14-7-9-15(25-2)10-8-14/h3-10H,11H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)c3ccc(cc3)F | |
| AKOS005250664 | 357.336 | C18 H16 F N3 O4 | LWXGRQPCKLLJME-UHFFFAOYSA-N | InChI=1S/C18H16FN3O4/c1-25-15-8-6-14(7-9-15)22-16(18(24)26-21-22)17(23)20-11-10-12-2-4-13(19)5-3-12/h2-9H,10-11H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCCc3ccc(cc3)F | |
| AKOS005250665 | 357.336 | C18 H16 F N3 O4 | IAIYKQMWOQQHRR-UHFFFAOYSA-N | InChI=1S/C18H16FN3O4/c1-25-14-8-6-13(7-9-14)22-16(18(24)26-21-22)17(23)20-11-10-12-4-2-3-5-15(12)19/h2-9H,10-11H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCCc3ccccc3F | |
| AKOS005251844 | 389.401 | C18 H16 F N3 O4 S | JDLYYXFNOWSSSZ-UHFFFAOYSA-N | InChI=1S/C18H16FN3O4S/c1-11(16(23)20-15-6-4-3-5-14(15)19)27-17-18(24)26-21-22(17)12-7-9-13(25-2)10-8-12/h3-11H,1-2H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccccc1F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251845 | 389.401 | C18 H16 F N3 O4 S | FLEWQBNDQBYEIV-UHFFFAOYSA-N | InChI=1S/C18H16FN3O4S/c1-11(16(23)20-13-5-3-12(19)4-6-13)27-17-18(24)26-21-22(17)14-7-9-15(25-2)10-8-14/h3-11H,1-2H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccc(cc1)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252203 | 389.401 | C18 H16 F N3 O4 S | VHWCNMGZKNSZAS-UHFFFAOYSA-N | InChI=1S/C18H16FN3O4S/c1-25-13-8-6-12(7-9-13)22-17(18(24)26-21-22)27-11-10-16(23)20-15-5-3-2-4-14(15)19/h2-9H,10-11H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccccc3F | |
| AKOS005252204 | 389.401 | C18 H16 F N3 O4 S | SQSUJUKUFFVOIX-UHFFFAOYSA-N | InChI=1S/C18H16FN3O4S/c1-25-15-8-6-14(7-9-15)22-17(18(24)26-21-22)27-11-10-16(23)20-13-4-2-12(19)3-5-13/h2-9H,10-11H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)F | |
| AKOS005252103 | 481.307 | C18 H16 I N3 O3 S | HDXMZDDGOQJIQB-UHFFFAOYSA-N | InChI=1S/C18H16IN3O3S/c1-2-15(16(23)20-13-10-8-12(19)9-11-13)26-17-18(24)25-21-22(17)14-6-4-3-5-7-14/h3-11,15H,2H2,1H3,(H-,20,21,23,24) | CCC(C(=O)Nc1ccc(cc1)I)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251852 | 497.307 | C18 H16 I N3 O4 S | BSGSRAUMZYCSKZ-UHFFFAOYSA-N | InChI=1S/C18H16IN3O4S/c1-11(16(23)20-13-5-3-12(19)4-6-13)27-17-18(24)26-21-22(17)14-7-9-15(25-2)10-8-14/h3-11H,1-2H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccc(cc1)I)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252211 | 497.307 | C18 H16 I N3 O4 S | XZYAEGJIAQTUQT-UHFFFAOYSA-N | InChI=1S/C18H16IN3O4S/c1-25-15-8-6-14(7-9-15)22-17(18(24)26-21-22)27-11-10-16(23)20-13-4-2-12(19)3-5-13/h2-9H,10-11H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)I | |
| AKOS005250419 | 356.396 | C18 H16 N2 O4 S | NMCMTZKDWLRIKM-UHFFFAOYSA-N | InChI=1S/C18H16N2O4S/c1-23-15-9-7-14(8-10-15)20-17(18(22)24-19-20)16(21)12-25-11-13-5-3-2-4-6-13/h2-10H,11-12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSCc3ccccc3 | |
| AKOS005250420 | 356.396 | C18 H16 N2 O4 S | ICRVMJVNCNOIMC-UHFFFAOYSA-N | InChI=1S/C18H16N2O4S/c1-12-3-9-15(10-4-12)25-11-16(21)17-18(22)24-19-20(17)13-5-7-14(23-2)8-6-13/h3-10H,11H2,1-2H3 | Cc1ccc(cc1)SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251250 | 368.41 | C18 H16 N4 O3 S | SONLMTRUIFMWAH-UHFFFAOYSA-N | InChI=1S/C18H16N4O3S/c1-20(11-14-17(23)25-19-21(14)2)18(24)22-12-7-3-5-9-15(12)26-16-10-6-4-8-13(16)22/h3-10H,11H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)N2c3ccccc3Sc4c2cccc4 | |
| AKOS005250937 | 384.409 | C18 H16 N4 O4 S | QIOOYJRMMOGULB-UHFFFAOYSA-O | InChI=1S/C18H15N4O4S/c1-22-15(18(25)26-21-22)10-14(17(24)19-11-13-8-5-9-27-13)20-16(23)12-6-3-2-4-7-12/h2-10H,11H2,1H3,(H,19,24)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCc2cccs2)\NC(=O)c3ccccc3 | |
| AKOS005251194 | 384.409 | C18 H16 N4 O4 S | RUSBPBDWQDHCAS-UHFFFAOYSA-N | InChI=1S/C18H16N4O4S/c1-12(23)19-13-7-9-14(10-8-13)20-16(24)11-27-17-18(25)26-21-22(17)15-5-3-2-4-6-15/h2-10,21,25H,11H2,1H3 | CC(=O)Nc1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251872 | 384.409 | C18 H16 N4 O4 S | ZRALKCHGHQQOAH-UHFFFAOYSA-N | InChI=1S/C18H16N4O4S/c1-11(16(24)20-13-9-7-12(8-10-13)15(19)23)27-17-18(25)26-21-22(17)14-5-3-2-4-6-14/h2-11H,1H3,(H3-,19,20,21,23,24,25) | CC(C(=O)Nc1ccc(cc1)C(=O)N)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251873 | 384.409 | C18 H16 N4 O4 S | FZAVXTZDJOJCSL-UHFFFAOYSA-N | InChI=1S/C18H16N4O4S/c1-11(16(24)20-14-10-6-5-9-13(14)15(19)23)27-17-18(25)26-21-22(17)12-7-3-2-4-8-12/h2-11H,1H3,(H3-,19,20,21,23,24,25) | CC(C(=O)Nc1ccccc1C(=O)N)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252155 | 384.409 | C18 H16 N4 O4 S | ZAMBQISBZAOJHJ-UHFFFAOYSA-N | InChI=1S/C18H16N4O4S/c19-16(24)12-6-8-13(9-7-12)20-15(23)10-11-27-17-18(25)26-21-22(17)14-4-2-1-3-5-14/h1-9H,10-11H2,(H3-,19,20,21,23,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)C(=O)N | |
| AKOS005252156 | 384.409 | C18 H16 N4 O4 S | PZLMAJRBLVAKHI-UHFFFAOYSA-N | InChI=1S/C18H16N4O4S/c19-16(24)13-8-4-5-9-14(13)20-15(23)10-11-27-17-18(25)26-21-22(17)12-6-2-1-3-7-12/h1-9H,10-11H2,(H3-,19,20,21,23,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccccc3C(=O)N | |
| AKOS005219470 | 368.343 | C18 H16 N4 O5 | DOTGLIFPXVEYKZ-UHFFFAOYSA-N | InChI=1S/C18H16N4O5/c1-3-25-17(23)13-10(2)26-16(20)12(9-19)14(13)15-18(24)27-21-22(15)11-7-5-4-6-8-11/h4-8,14H,3,20H2,1-2H3 | CCOC(=O)C1=C(OC(=C(C1c2c(on[n+]2c3ccccc3)[O-])C#N)N)C | |
| AKOS005250115 | 368.343 | C18 H16 N4 O5 | BVMQZHUDMVPZRX-UHFFFAOYSA-N | InChI=1S/C18H16N4O5/c1-9(23)14-10(2)26-17(20)13(8-19)15(14)16-18(24)27-21-22(16)11-4-6-12(25-3)7-5-11/h4-7,15H,20H2,1-3H3 | CC1=C(C(C(=C(O1)N)C#N)c2c(on[n+]2c3ccc(cc3)OC)[O-])C(=O)C | |
| AKOS005250184 | 368.343 | C18 H16 N4 O5 | BVHTZZMBJRVXHZ-UHFFFAOYSA-N | InChI=1S/C18H16N4O5/c1-11(23)19-12-3-5-13(6-4-12)20-17(24)16-18(25)27-21-22(16)14-7-9-15(26-2)10-8-14/h3-10,21H,1-2H3,(H,24,25) | CC(=O)Nc1ccc(cc1)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250484 | 368.343 | C18 H16 N4 O5 | VGXQLQROLMBJOP-UHFFFAOYSA-N | InChI=1S/C18H16N4O5/c23-16(14-7-4-12-26-14)20-8-10-21(11-9-20)17(24)15-18(25)27-19-22(15)13-5-2-1-3-6-13/h1-7,12H,8-11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)C(=O)c4ccco4 | |
| AKOS005250959 | 368.343 | C18 H16 N4 O5 | AMDJLBRARZHHPC-UHFFFAOYSA-O | InChI=1S/C18H15N4O5/c1-22-15(18(25)27-21-22)10-14(17(24)19-11-13-8-5-9-26-13)20-16(23)12-6-3-2-4-7-12/h2-10H,11H2,1H3,(H,19,24)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCc2ccco2)\NC(=O)c3ccccc3 | |
| AKOS005251567 | 400.408 | C18 H16 N4 O5 S | KWCVUEYWTNNQES-UHFFFAOYSA-N | InChI=1S/C18H16N4O5S/c1-26-14-8-6-13(7-9-14)22-17(18(25)27-21-22)28-10-15(23)20-12-4-2-11(3-5-12)16(19)24/h2-9H,10H2,1H3,(H3-,19,20,21,23,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)C(=O)N | |
| AKOS005251574 | 400.408 | C18 H16 N4 O5 S | NWMSJQOJLNJZSG-UHFFFAOYSA-N | InChI=1S/C18H16N4O5S/c1-26-12-8-6-11(7-9-12)22-17(18(25)27-21-22)28-10-15(23)20-14-5-3-2-4-13(14)16(19)24/h2-9H,10H2,1H3,(H3-,19,20,21,23,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccccc3C(=O)N | |
| AKOS005251868 | 400.408 | C18 H16 N4 O5 S | GMNQMPZHFRZENA-UHFFFAOYSA-N | InChI=1S/C18H16N4O5S/c1-11-10-14(22(25)26)8-9-15(11)19-16(23)12(2)28-17-18(24)27-20-21(17)13-6-4-3-5-7-13/h3-10,12H,1-2H3,(H-,19,20,23,24) | Cc1cc(ccc1NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-])[N+](=O)[O-] | |
| AKOS005251869 | 400.408 | C18 H16 N4 O5 S | OJDZHHOCDAJGPR-UHFFFAOYSA-N | InChI=1S/C18H16N4O5S/c1-11-8-9-14(22(25)26)10-15(11)19-16(23)12(2)28-17-18(24)27-20-21(17)13-6-4-3-5-7-13/h3-10,12H,1-2H3,(H-,19,20,23,24) | Cc1ccc(cc1NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-])[N+](=O)[O-] | |
| AKOS005252264 | 400.408 | C18 H16 N4 O5 S | IZVPBLSPKPPINK-UHFFFAOYSA-N | InChI=1S/C18H16N4O5S/c1-12-11-14(22(25)26)7-8-15(12)19-16(23)9-10-28-17-18(24)27-20-21(17)13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H-,19,20,23,24) | Cc1cc(ccc1NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-])[N+](=O)[O-] | |
| AKOS005252265 | 400.408 | C18 H16 N4 O5 S | JNLAQKWZBPAGEJ-UHFFFAOYSA-N | InChI=1S/C18H16N4O5S/c1-12-7-8-14(22(25)26)11-15(12)19-16(23)9-10-28-17-18(24)27-20-21(17)13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H-,19,20,23,24) | Cc1ccc(cc1NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-])[N+](=O)[O-] | |
| AKOS005250287 | 384.343 | C18 H16 N4 O6 | BABFGDQCLSOTEL-UHFFFAOYSA-N | InChI=1S/C18H16N4O6/c1-20(17(23)12-4-3-5-14(10-12)22(25)26)11-16-18(24)28-19-21(16)13-6-8-15(27-2)9-7-13/h3-10H,11H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)c3cccc(c3)[N+](=O)[O-] | |
| AKOS005250294 | 384.343 | C18 H16 N4 O6 | WCRNZLQECOGYCZ-UHFFFAOYSA-N | InChI=1S/C18H16N4O6/c1-20(17(23)12-3-5-14(6-4-12)22(25)26)11-16-18(24)28-19-21(16)13-7-9-15(27-2)10-8-13/h3-10H,11H2,1-2H3/q-2 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)c3ccc(cc3)[N-](=O)[O-] | |
| AKOS005250624 | 416.408 | C18 H16 N4 O6 S | GJKJVCFLZBRDDJ-UHFFFAOYSA-N | InChI=1S/C18H16N4O6S/c1-9-11(17(25)27-3)16(20-14(23)12-18(26)28-21-22(12)2)29-13(9)15(24)19-10-7-5-4-6-8-10/h4-8H,1-3H3,(H2-,19,20,21,23,24,25,26) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)c3c(on[n+]3C)[O-])C(=O)OC | |
| AKOS005251543 | 416.408 | C18 H16 N4 O6 S | LBUQUOXDXQXJNG-UHFFFAOYSA-N | InChI=1S/C18H16N4O6S/c1-11-9-13(22(25)26)5-8-15(11)19-16(23)10-29-17-18(24)28-20-21(17)12-3-6-14(27-2)7-4-12/h3-9H,10H2,1-2H3,(H-,19,20,23,24) | Cc1cc(ccc1NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-])[N+](=O)[O-] | |
| AKOS005251544 | 416.408 | C18 H16 N4 O6 S | BLYOQSCPFCCZIH-UHFFFAOYSA-N | InChI=1S/C18H16N4O6S/c1-11-3-4-13(22(25)26)9-15(11)19-16(23)10-29-17-18(24)28-20-21(17)12-5-7-14(27-2)8-6-12/h3-9H,10H2,1-2H3,(H-,19,20,23,24) | Cc1ccc(cc1NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-])[N+](=O)[O-] | |
| AKOS005252737 | 380.424 | C18 H16 N6 O2 S | CSFKYVLOKKLJCX-UHFFFAOYSA-N | InChI=1S/C18H16N6O2S/c1-23(2)24-11-17(26-22-24)21-16(25)12-27-18-14(10-19)8-9-15(20-18)13-6-4-3-5-7-13/h3-9,11H,12H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)c3ccccc3)C#N | |
| AKOS005214775 | 378.252 | C18 H17 Cl2 N3 O2 | HQBQGOOCMYAUGF-UHFFFAOYSA-N | InChI=1S/C18H17Cl2N3O2/c1-12-2-6-15(7-3-12)23-17(18(24)25-22-23)11-21-9-8-13-4-5-14(19)10-16(13)20/h2-7,10,21H,8-9,11H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccc(cc3Cl)Cl | |
| AKOS005214793 | 394.252 | C18 H17 Cl2 N3 O3 | LTXSPYBUXRSOCA-UHFFFAOYSA-N | InChI=1S/C18H17Cl2N3O3/c1-25-15-6-4-14(5-7-15)23-17(18(24)26-22-23)11-21-9-8-12-2-3-13(19)10-16(12)20/h2-7,10,21H,8-9,11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccc(cc3Cl)Cl | |
| AKOS005250254 | 323.346 | C18 H17 N3 O3 | WMTFEJFHVIGINN-UHFFFAOYSA-N | InChI=1S/C18H17N3O3/c1-20(17(22)12-14-8-4-2-5-9-14)13-16-18(23)24-19-21(16)15-10-6-3-7-11-15/h2-11H,12-13H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)Cc3ccccc3 | |
| AKOS005250256 | 323.346 | C18 H17 N3 O3 | LGHXFTDTSGBCCV-UHFFFAOYSA-N | InChI=1S/C18H17N3O3/c1-13-8-6-7-11-15(13)17(22)20(2)12-16-18(23)24-19-21(16)14-9-4-3-5-10-14/h3-11H,12H2,1-2H3 | Cc1ccccc1C(=O)N(C)Cc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250257 | 323.346 | C18 H17 N3 O3 | WIYZOWWNCSVQEQ-UHFFFAOYSA-N | InChI=1S/C18H17N3O3/c1-13-7-6-8-14(11-13)17(22)20(2)12-16-18(23)24-19-21(16)15-9-4-3-5-10-15/h3-11H,12H2,1-2H3 | Cc1cccc(c1)C(=O)N(C)Cc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250258 | 323.346 | C18 H17 N3 O3 | QWLHRETZWQIFNE-UHFFFAOYSA-N | InChI=1S/C18H17N3O3/c1-13-8-10-14(11-9-13)17(22)20(2)12-16-18(23)24-19-21(16)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3 | Cc1ccc(cc1)C(=O)N(C)Cc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251182 | 355.411 | C18 H17 N3 O3 S | XIHMSJLJUZSGMZ-UHFFFAOYSA-N | InChI=1S/C18H17N3O3S/c1-12-7-6-10-15(13(12)2)19-16(22)11-25-17-18(23)24-20-21(17)14-8-4-3-5-9-14/h3-10H,11H2,1-2H3,(H-,19,20,22,23) | Cc1cccc(c1C)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251189 | 355.411 | C18 H17 N3 O3 S | IMDHVYQDDZXNPF-UHFFFAOYSA-N | InChI=1S/C18H17N3O3S/c1-12-8-9-15(13(2)10-12)19-16(22)11-25-17-18(23)24-20-21(17)14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H-,19,20,22,23) | Cc1ccc(c(c1)C)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251190 | 355.411 | C18 H17 N3 O3 S | YKTMCQQGTHNOIY-UHFFFAOYSA-N | InChI=1S/C18H17N3O3S/c1-12-8-9-13(2)15(10-12)19-16(22)11-25-17-18(23)24-20-21(17)14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H-,19,20,22,23) | Cc1ccc(c(c1)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-])C | |
| AKOS005251191 | 355.411 | C18 H17 N3 O3 S | OSDDTXTWQSIODK-UHFFFAOYSA-N | InChI=1S/C18H17N3O3S/c1-12-7-6-8-13(2)16(12)19-15(22)11-25-17-18(23)24-20-21(17)14-9-4-3-5-10-14/h3-10H,11H2,1-2H3,(H-,19,20,22,23) | Cc1cccc(c1NC(=O)CSc2c(on[n+]2c3ccccc3)[O-])C | |
| AKOS005251197 | 355.411 | C18 H17 N3 O3 S | FSYHHLIFTZZCRN-UHFFFAOYSA-N | InChI=1S/C18H17N3O3S/c1-12-8-9-14(10-13(12)2)19-16(22)11-25-17-18(23)24-20-21(17)15-6-4-3-5-7-15/h3-10H,11H2,1-2H3,(H-,19,20,22,23) | Cc1ccc(cc1C)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251198 | 355.411 | C18 H17 N3 O3 S | KFRPPITZXZNKTM-UHFFFAOYSA-N | InChI=1S/C18H17N3O3S/c1-12-8-13(2)10-14(9-12)19-16(22)11-25-17-18(23)24-20-21(17)15-6-4-3-5-7-15/h3-10H,11H2,1-2H3,(H-,19,20,22,23) | Cc1cc(cc(c1)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-])C | |
| AKOS005251421 | 355.411 | C18 H17 N3 O3 S | SVZQIKLVARLTMB-UHFFFAOYSA-N | InChI=1S/C18H17N3O3S/c1-12-8-10-14(11-9-12)19-16(22)13(2)25-17-18(23)24-20-21(17)15-6-4-3-5-7-15/h3-11,13H,1-2H3,(H-,19,20,22,23) | Cc1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251500 | 355.411 | C18 H17 N3 O3 S | MCNFSUPZVHQNKN-UHFFFAOYSA-N | InChI=1S/C18H17N3O3S/c1-12-8-6-7-11-15(12)19-16(22)13(2)25-17-18(23)24-20-21(17)14-9-4-3-5-10-14/h3-11,13H,1-2H3,(H-,19,20,22,23) | Cc1ccccc1NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251501 | 355.411 | C18 H17 N3 O3 S | CNLSKLXXZIIHMV-UHFFFAOYSA-N | InChI=1S/C18H17N3O3S/c1-12-7-6-8-14(11-12)19-16(22)13(2)25-17-18(23)24-20-21(17)15-9-4-3-5-10-15/h3-11,13H,1-2H3,(H-,19,20,22,23) | Cc1cccc(c1)NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251693 | 355.411 | C18 H17 N3 O3 S | CBBRTYLPBYJQGS-UHFFFAOYSA-N | InChI=1S/C18H17N3O3S/c1-2-15(16(22)19-13-9-5-3-6-10-13)25-17-18(23)24-20-21(17)14-11-7-4-8-12-14/h3-12,15H,2H2,1H3,(H-,19,20,22,23) | CCC(C(=O)Nc1ccccc1)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252313 | 355.411 | C18 H17 N3 O3 S | KHOAQKXMHRZHJP-UHFFFAOYSA-N | InChI=1S/C18H17N3O3S/c1-13-7-9-14(10-8-13)19-16(22)11-12-25-17-18(23)24-20-21(17)15-5-3-2-4-6-15/h2-10H,11-12H2,1H3,(H-,19,20,22,23) | Cc1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252366 | 355.411 | C18 H17 N3 O3 S | FIKXUQSVRKSEMZ-UHFFFAOYSA-N | InChI=1S/C18H17N3O3S/c1-13-7-5-6-10-15(13)19-16(22)11-12-25-17-18(23)24-20-21(17)14-8-3-2-4-9-14/h2-10H,11-12H2,1H3,(H-,19,20,22,23) | Cc1ccccc1NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252367 | 355.411 | C18 H17 N3 O3 S | NNPFZCGSOXRTPA-UHFFFAOYSA-N | InChI=1S/C18H17N3O3S/c1-13-6-5-7-14(12-13)19-16(22)10-11-25-17-18(23)24-20-21(17)15-8-3-2-4-9-15/h2-9,12H,10-11H2,1H3,(H-,19,20,22,23) | Cc1cccc(c1)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005214713 | 339.345 | C18 H17 N3 O4 | PSMLBGOELGVGRN-UHFFFAOYSA-N | InChI=1S/C18H17N3O4/c1-12-2-5-14(6-3-12)21-15(18(22)25-20-21)10-19-9-13-4-7-16-17(8-13)24-11-23-16/h2-8,19H,9-11H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3ccc4c(c3)OCO4 | |
| AKOS005250119 | 339.345 | C18 H17 N3 O4 | RCTIOJIVMODNMY-UHFFFAOYSA-N | InChI=1S/C18H17N3O4/c1-11-5-4-6-15(12(11)2)19-17(22)16-18(23)25-20-21(16)13-7-9-14(24-3)10-8-13/h4-10H,1-3H3,(H-,19,20,22,23) | Cc1cccc(c1C)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250130 | 339.345 | C18 H17 N3 O4 | RMUMOCSHMOWGIR-UHFFFAOYSA-N | InChI=1S/C18H17N3O4/c1-11-5-4-6-12(2)15(11)19-17(22)16-18(23)25-20-21(16)13-7-9-14(24-3)10-8-13/h4-10H,1-3H3,(H-,19,20,22,23) | Cc1cccc(c1NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005250181 | 339.345 | C18 H17 N3 O4 | PUHCZIRURSLUEX-UHFFFAOYSA-N | InChI=1S/C18H17N3O4/c1-12(13-6-4-3-5-7-13)19-17(22)16-18(23)25-20-21(16)14-8-10-15(24-2)11-9-14/h3-12H,1-2H3,(H-,19,20,22,23) | CC(c1ccccc1)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250182 | 339.345 | C18 H17 N3 O4 | VDADIRNBBKYALF-UHFFFAOYSA-N | InChI=1S/C18H17N3O4/c1-12-3-5-13(6-4-12)11-19-17(22)16-18(23)25-20-21(16)14-7-9-15(24-2)10-8-14/h3-10H,11H2,1-2H3,(H-,19,20,22,23) | Cc1ccc(cc1)CNC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250205 | 339.345 | C18 H17 N3 O4 | AZILPZMLDSIQNG-UHFFFAOYSA-N | InChI=1S/C18H17N3O4/c1-24-15-9-7-14(8-10-15)21-16(18(23)25-20-21)17(22)19-12-11-13-5-3-2-4-6-13/h2-10H,11-12H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCCc3ccccc3 | |
| AKOS005250224 | 339.345 | C18 H17 N3 O4 | NGMFQMUOYPIGEA-UHFFFAOYSA-N | InChI=1S/C18H17N3O4/c1-11-4-9-15(12(2)10-11)19-17(22)16-18(23)25-20-21(16)13-5-7-14(24-3)8-6-13/h4-10H,1-3H3,(H-,19,20,22,23) | Cc1ccc(c(c1)C)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250225 | 339.345 | C18 H17 N3 O4 | YGJCATPXRBIZLH-UHFFFAOYSA-N | InChI=1S/C18H17N3O4/c1-11-4-5-12(2)15(10-11)19-17(22)16-18(23)25-20-21(16)13-6-8-14(24-3)9-7-13/h4-10H,1-3H3,(H-,19,20,22,23) | Cc1ccc(c(c1)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005250232 | 339.345 | C18 H17 N3 O4 | KNXBODZAHJRYKW-UHFFFAOYSA-N | InChI=1S/C18H17N3O4/c1-11-4-5-13(10-12(11)2)19-17(22)16-18(23)25-20-21(16)14-6-8-15(24-3)9-7-14/h4-10H,1-3H3,(H-,19,20,22,23) | Cc1ccc(cc1C)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250233 | 339.345 | C18 H17 N3 O4 | PMKUQSCEXMNXSO-UHFFFAOYSA-N | InChI=1S/C18H17N3O4/c1-11-8-12(2)10-13(9-11)19-17(22)16-18(23)25-20-21(16)14-4-6-15(24-3)7-5-14/h4-10H,1-3H3,(H-,19,20,22,23) | Cc1cc(cc(c1)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005250253 | 339.345 | C18 H17 N3 O4 | DHRXCYWBPLCERO-UHFFFAOYSA-N | InChI=1S/C18H17N3O4/c1-20(17(22)13-24-15-10-6-3-7-11-15)12-16-18(23)25-19-21(16)14-8-4-2-5-9-14/h2-11H,12-13H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)COc3ccccc3 | |
| AKOS005250370 | 339.345 | C18 H17 N3 O4 | SAZARNRPLHVGEG-UHFFFAOYSA-N | InChI=1S/C18H17N3O4/c1-20(17(22)13-7-6-10-15(11-13)24-2)12-16-18(23)25-19-21(16)14-8-4-3-5-9-14/h3-11H,12H2,1-2H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)c3cccc(c3)OC | |
| AKOS005250371 | 339.345 | C18 H17 N3 O4 | FCZVBEFEKBRYMW-UHFFFAOYSA-N | InChI=1S/C18H17N3O4/c1-20(17(22)13-8-10-15(24-2)11-9-13)12-16-18(23)25-19-21(16)14-6-4-3-5-7-14/h3-11H,12H2,1-2H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)c3ccc(cc3)OC | |
| AKOS005250315 | 371.41 | C18 H17 N3 O4 S | UTYSMPVPNFFSLW-UHFFFAOYSA-N | InChI=1S/C18H17N3O4S/c1-24-15-6-4-14(5-7-15)21-16(18(23)25-19-21)10-20(13-2-3-13)17(22)12-8-9-26-11-12/h4-9,11,13H,2-3,10H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4ccsc4 | |
| AKOS005250346 | 371.41 | C18 H17 N3 O4 S | XVWNJIZPPKARKA-UHFFFAOYSA-N | InChI=1S/C18H17N3O4S/c1-24-14-8-6-13(7-9-14)21-15(18(23)25-19-21)11-20(12-4-5-12)17(22)16-3-2-10-26-16/h2-3,6-10,12H,4-5,11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4cccs4 | |
| AKOS005251154 | 371.41 | C18 H17 N3 O4 S | RXVBXBUBKVMCSZ-UHFFFAOYSA-N | InChI=1S/C18H17N3O4S/c1-2-24-15-11-7-6-10-14(15)19-16(22)12-26-17-18(23)25-20-21(17)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3,(H-,19,20,22,23) | CCOc1ccccc1NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251161 | 371.41 | C18 H17 N3 O4 S | ISEDCRGSMNLGCF-UHFFFAOYSA-N | InChI=1S/C18H17N3O4S/c1-2-24-15-10-8-13(9-11-15)19-16(22)12-26-17-18(23)25-20-21(17)14-6-4-3-5-7-14/h3-11H,2,12H2,1H3,(H-,19,20,22,23) | CCOc1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251426 | 371.41 | C18 H17 N3 O4 S | KQYGYGNBZSUDTG-UHFFFAOYSA-N | InChI=1S/C18H17N3O4S/c1-12(26-17-18(23)25-20-21(17)2)16(22)19-13-8-10-15(11-9-13)24-14-6-4-3-5-7-14/h3-12H,1-2H3,(H-,19,20,22,23) | CC(C(=O)Nc1ccc(cc1)Oc2ccccc2)Sc3c(on[n+]3C)[O-] | |
| AKOS005251531 | 371.41 | C18 H17 N3 O4 S | LDNYFAZITLMGIE-UHFFFAOYSA-N | InChI=1S/C18H17N3O4S/c1-12-5-3-4-6-15(12)19-16(22)11-26-17-18(23)25-20-21(17)13-7-9-14(24-2)10-8-13/h3-10H,11H2,1-2H3,(H-,19,20,22,23) | Cc1ccccc1NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251633 | 371.41 | C18 H17 N3 O4 S | UIJNUMICKZOCPY-UHFFFAOYSA-N | InChI=1S/C18H17N3O4S/c1-12-4-3-5-13(10-12)19-16(22)11-26-17-18(23)25-20-21(17)14-6-8-15(24-2)9-7-14/h3-10H,11H2,1-2H3,(H-,19,20,22,23) | Cc1cccc(c1)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251634 | 371.41 | C18 H17 N3 O4 S | GBYBDNOATZSVIQ-UHFFFAOYSA-N | InChI=1S/C18H17N3O4S/c1-12-3-5-13(6-4-12)19-16(22)11-26-17-18(23)25-20-21(17)14-7-9-15(24-2)10-8-14/h3-10H,11H2,1-2H3,(H-,19,20,22,23) | Cc1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251778 | 371.41 | C18 H17 N3 O4 S | SSSBPJXEZATPCI-UHFFFAOYSA-N | InChI=1S/C18H17N3O4S/c1-12(16(22)19-13-6-4-3-5-7-13)26-17-18(23)25-20-21(17)14-8-10-15(24-2)11-9-14/h3-12H,1-2H3,(H-,19,20,22,23) | CC(C(=O)Nc1ccccc1)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251874 | 371.41 | C18 H17 N3 O4 S | GCHFVNZCKXDBAR-UHFFFAOYSA-N | InChI=1S/C18H17N3O4S/c1-12(16(22)19-14-10-6-7-11-15(14)24-2)26-17-18(23)25-20-21(17)13-8-4-3-5-9-13/h3-12H,1-2H3,(H-,19,20,22,23) | CC(C(=O)Nc1ccccc1OC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251875 | 371.41 | C18 H17 N3 O4 S | MBWCDTVCIMUXEU-UHFFFAOYSA-N | InChI=1S/C18H17N3O4S/c1-12(16(22)19-13-7-6-10-15(11-13)24-2)26-17-18(23)25-20-21(17)14-8-4-3-5-9-14/h3-12H,1-2H3,(H-,19,20,22,23) | CC(C(=O)Nc1cccc(c1)OC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251882 | 371.41 | C18 H17 N3 O4 S | KFFXHLIJDSTEKM-UHFFFAOYSA-N | InChI=1S/C18H17N3O4S/c1-12(16(22)19-13-8-10-15(24-2)11-9-13)26-17-18(23)25-20-21(17)14-6-4-3-5-7-14/h3-12H,1-2H3,(H-,19,20,22,23) | CC(C(=O)Nc1ccc(cc1)OC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252143 | 371.41 | C18 H17 N3 O4 S | AVXMSUBSPVFNKW-UHFFFAOYSA-N | InChI=1S/C18H17N3O4S/c1-24-15-9-7-13(8-10-15)19-16(22)11-12-26-17-18(23)25-20-21(17)14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252183 | 371.41 | C18 H17 N3 O4 S | GTWUQUVNZOWSFD-UHFFFAOYSA-N | InChI=1S/C18H17N3O4S/c1-24-15-9-7-14(8-10-15)21-17(18(23)25-20-21)26-12-11-16(22)19-13-5-3-2-4-6-13/h2-10H,11-12H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccccc3 | |
| AKOS005252262 | 371.41 | C18 H17 N3 O4 S | SECUEUJCBXEIIF-UHFFFAOYSA-N | InChI=1S/C18H17N3O4S/c1-24-15-10-6-5-9-14(15)19-16(22)11-12-26-17-18(23)25-20-21(17)13-7-3-2-4-8-13/h2-10H,11-12H2,1H3,(H-,19,20,22,23) | COc1ccccc1NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252263 | 371.41 | C18 H17 N3 O4 S | BFULBNMRGMKSRP-UHFFFAOYSA-N | InChI=1S/C18H17N3O4S/c1-24-15-9-5-6-13(12-15)19-16(22)10-11-26-17-18(23)25-20-21(17)14-7-3-2-4-8-14/h2-9,12H,10-11H2,1H3,(H-,19,20,22,23) | COc1cccc(c1)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252351 | 371.41 | C18 H17 N3 O4 S | QXJNGJIJQMDWJW-UHFFFAOYSA-N | InChI=1S/C18H17N3O4S/c1-21-17(18(23)25-20-21)26-12-11-16(22)19-13-7-9-15(10-8-13)24-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H-,19,20,22,23) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2)Oc3ccccc3 | |
| AKOS005214711 | 355.345 | C18 H17 N3 O5 | SSEGUEWFSMPKLC-UHFFFAOYSA-N | InChI=1S/C18H17N3O5/c1-23-14-5-3-13(4-6-14)21-15(18(22)26-20-21)10-19-9-12-2-7-16-17(8-12)25-11-24-16/h2-8,19H,9-11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCc3ccc4c(c3)OCO4 | |
| AKOS005250144 | 355.345 | C18 H17 N3 O5 | DRWHWTVFJULIAX-UHFFFAOYSA-N | InChI=1S/C18H17N3O5/c1-3-25-15-7-5-4-6-14(15)19-17(22)16-18(23)26-20-21(16)12-8-10-13(24-2)11-9-12/h4-11H,3H2,1-2H3,(H-,19,20,22,23) | CCOc1ccccc1NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250151 | 355.345 | C18 H17 N3 O5 | IOHGXEVFNCGWEZ-UHFFFAOYSA-N | InChI=1S/C18H17N3O5/c1-3-25-15-8-4-12(5-9-15)19-17(22)16-18(23)26-20-21(16)13-6-10-14(24-2)11-7-13/h4-11H,3H2,1-2H3,(H-,19,20,22,23) | CCOc1ccc(cc1)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250321 | 355.345 | C18 H17 N3 O5 | CZWIKMFPMDTUSN-UHFFFAOYSA-N | InChI=1S/C18H17N3O5/c1-24-14-8-6-13(7-9-14)21-15(18(23)26-19-21)11-20(12-4-5-12)17(22)16-3-2-10-25-16/h2-3,6-10,12H,4-5,11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4ccco4 | |
| AKOS005251176 | 387.41 | C18 H17 N3 O5 S | UFLKEVFIJUDGIP-UHFFFAOYSA-N | InChI=1S/C18H17N3O5S/c1-24-13-8-9-14(15(10-13)25-2)19-16(22)11-27-17-18(23)26-20-21(17)12-6-4-3-5-7-12/h3-10H,11H2,1-2H3,(H-,19,20,22,23) | COc1ccc(c(c1)OC)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251183 | 387.41 | C18 H17 N3 O5 S | GQUHDWWDEOZWME-UHFFFAOYSA-N | InChI=1S/C18H17N3O5S/c1-24-13-8-9-15(25-2)14(10-13)19-16(22)11-27-17-18(23)26-20-21(17)12-6-4-3-5-7-12/h3-10H,11H2,1-2H3,(H-,19,20,22,23) | COc1ccc(c(c1)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-])OC | |
| AKOS005251184 | 387.41 | C18 H17 N3 O5 S | OTFWVSONGAZEPE-UHFFFAOYSA-N | InChI=1S/C18H17N3O5S/c1-24-14-8-12(9-15(10-14)25-2)19-16(22)11-27-17-18(23)26-20-21(17)13-6-4-3-5-7-13/h3-10H,11H2,1-2H3,(H-,19,20,22,23) | COc1cc(cc(c1)OC)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251535 | 387.41 | C18 H17 N3 O5 S | BLJJPQBGHITJMD-UHFFFAOYSA-N | InChI=1S/C18H17N3O5S/c1-24-13-9-7-12(8-10-13)21-17(18(23)26-20-21)27-11-16(22)19-14-5-3-4-6-15(14)25-2/h3-10H,11H2,1-2H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccccc3OC | |
| AKOS005251536 | 387.41 | C18 H17 N3 O5 S | SXJLXFRVGUFEMO-UHFFFAOYSA-N | InChI=1S/C18H17N3O5S/c1-24-14-8-6-13(7-9-14)21-17(18(23)26-20-21)27-11-16(22)19-12-4-3-5-15(10-12)25-2/h3-10H,11H2,1-2H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cccc(c3)OC | |
| AKOS005251537 | 387.41 | C18 H17 N3 O5 S | PVFGWRBIXDEGPX-UHFFFAOYSA-N | InChI=1S/C18H17N3O5S/c1-24-14-7-3-12(4-8-14)19-16(22)11-27-17-18(23)26-20-21(17)13-5-9-15(25-2)10-6-13/h3-10H,11H2,1-2H3,(H-,19,20,22,23) | COc1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250127 | 371.344 | C18 H17 N3 O6 | DWUFAYYBFJDVPV-UHFFFAOYSA-N | InChI=1S/C18H17N3O6/c1-24-12-6-4-11(5-7-12)21-16(18(23)27-20-21)17(22)19-14-9-8-13(25-2)10-15(14)26-3/h4-10H,1-3H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(cc3OC)OC | |
| AKOS005250128 | 371.344 | C18 H17 N3 O6 | HGIPZNQGEJCFRG-UHFFFAOYSA-N | InChI=1S/C18H17N3O6/c1-24-12-6-4-11(5-7-12)21-16(18(23)27-20-21)17(22)19-14-10-13(25-2)8-9-15(14)26-3/h4-10H,1-3H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3cc(ccc3OC)OC | |
| AKOS005250129 | 371.344 | C18 H17 N3 O6 | LZJKUSMXCPOPEM-UHFFFAOYSA-N | InChI=1S/C18H17N3O6/c1-24-13-6-4-12(5-7-13)21-16(18(23)27-20-21)17(22)19-11-8-14(25-2)10-15(9-11)26-3/h4-10H,1-3H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3cc(cc(c3)OC)OC | |
| AKOS005250495 | 351.359 | C18 H17 N5 O3 | BHZXHBAVVRATMM-UHFFFAOYSA-N | InChI=1S/C18H17N5O3/c24-17(16-18(25)26-20-23(16)14-6-2-1-3-7-14)22-12-10-21(11-13-22)15-8-4-5-9-19-15/h1-9H,10-13H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)c4ccccn4 | |
| AKOS005253501 | 480.336 | C18 H18 Br N5 O4 S | UIIRXUWOCTXXNA-UHFFFAOYSA-N | InChI=1S/C18H18BrN5O4S/c1-22-14(17(27)28-21-22)9-23-13(16(26)24(18(23)29)12-6-7-12)8-15(25)20-11-4-2-10(19)3-5-11/h2-5,12-13H,6-9H2,1H3,(H-,20,21,25,27) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C3CC3)CC(=O)Nc4ccc(cc4)Br | |
| AKOS005214766 | 343.807 | C18 H18 Cl N3 O2 | KVKIAAFWOGNCIX-UHFFFAOYSA-N | InChI=1S/C18H18ClN3O2/c1-13-6-8-15(9-7-13)22-17(18(23)24-21-22)12-20-11-10-14-4-2-3-5-16(14)19/h2-9,20H,10-12H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccccc3Cl | |
| AKOS005214774 | 343.807 | C18 H18 Cl N3 O2 | BIGKIMZFWPVDBD-UHFFFAOYSA-N | InChI=1S/C18H18ClN3O2/c1-13-2-8-16(9-3-13)22-17(18(23)24-21-22)12-20-11-10-14-4-6-15(19)7-5-14/h2-9,20H,10-12H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccc(cc3)Cl | |
| AKOS005214836 | 343.807 | C18 H18 Cl N3 O2 | SKGGEGRRRDEPOR-UHFFFAOYSA-N | InChI=1S/C18H18ClN3O2/c1-13-5-7-16(8-6-13)22-17(18(23)24-21-22)12-20-10-9-14-3-2-4-15(19)11-14/h2-8,11,20H,9-10,12H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3cccc(c3)Cl | |
| AKOS005214782 | 359.807 | C18 H18 Cl N3 O3 | HXRSXZOKFQSYMO-UHFFFAOYSA-N | InChI=1S/C18H18ClN3O3/c1-24-15-8-6-14(7-9-15)22-17(18(23)25-21-22)12-20-11-10-13-4-2-3-5-16(13)19/h2-9,20H,10-12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccccc3Cl | |
| AKOS005214783 | 359.807 | C18 H18 Cl N3 O3 | VSDOIUMVCPLVJJ-UHFFFAOYSA-N | InChI=1S/C18H18ClN3O3/c1-24-16-8-6-15(7-9-16)22-17(18(23)25-21-22)12-20-11-10-13-2-4-14(19)5-3-13/h2-9,20H,10-12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccc(cc3)Cl | |
| AKOS005214833 | 359.807 | C18 H18 Cl N3 O3 | HETSBNXYPSJDEO-UHFFFAOYSA-N | InChI=1S/C18H18ClN3O3/c1-24-16-7-5-15(6-8-16)22-17(18(23)25-21-22)12-20-10-9-13-3-2-4-14(19)11-13/h2-8,11,20H,9-10,12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3cccc(c3)Cl | |
| AKOS005253021 | 435.951 | C18 H18 Cl N5 O2 S2 | OLEYTOVOEJMAHV-UHFFFAOYSA-N | InChI=1S/C18H18ClN5O2S2/c19-14-6-4-13(5-7-14)15-11-27-18(20-15)28-12-16(25)21-17-10-24(22-26-17)23-8-2-1-3-9-23/h4-7,10-11H,1-3,8-9,12H2 | c1cc(ccc1c2csc(n2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)Cl | |
| AKOS005253478 | 435.885 | C18 H18 Cl N5 O4 S | GDKHDKOMJYRCAD-UHFFFAOYSA-N | InChI=1S/C18H18ClN5O4S/c1-22-14(17(27)28-21-22)9-23-13(16(26)24(18(23)29)12-6-7-12)8-15(25)20-11-4-2-10(19)3-5-11/h2-5,12-13H,6-9H2,1H3,(H-,20,21,25,27) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C3CC3)CC(=O)Nc4ccc(cc4)Cl | |
| AKOS005214764 | 327.353 | C18 H18 F N3 O2 | OJEYDQMCZDSNPJ-UHFFFAOYSA-N | InChI=1S/C18H18FN3O2/c1-13-2-8-16(9-3-13)22-17(18(23)24-21-22)12-20-11-10-14-4-6-15(19)7-5-14/h2-9,20H,10-12H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccc(cc3)F | |
| AKOS005214765 | 327.353 | C18 H18 F N3 O2 | DOOIBSKRUORCKN-UHFFFAOYSA-N | InChI=1S/C18H18FN3O2/c1-13-6-8-15(9-7-13)22-17(18(23)24-21-22)12-20-11-10-14-4-2-3-5-16(14)19/h2-9,20H,10-12H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccccc3F | |
| AKOS005214772 | 343.352 | C18 H18 F N3 O3 | PPHVZIZDXLFZRD-UHFFFAOYSA-N | InChI=1S/C18H18FN3O3/c1-24-16-8-6-15(7-9-16)22-17(18(23)25-21-22)12-20-11-10-13-2-4-14(19)5-3-13/h2-9,20H,10-12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccc(cc3)F | |
| AKOS005214773 | 343.352 | C18 H18 F N3 O3 | MSQNKTZRWKCGIQ-UHFFFAOYSA-N | InChI=1S/C18H18FN3O3/c1-24-15-8-6-14(7-9-15)22-17(18(23)25-21-22)12-20-11-10-13-4-2-3-5-16(13)19/h2-9,20H,10-12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccccc3F | |
| AKOS005215571 | 379.813 | C18 H18 F N3 O3 . Cl H | DUVPRRUUVXFDLC-UHFFFAOYSA-N | InChI=1S/C18H18FN3O3.ClH/c1-24-16-8-6-15(7-9-16)22-17(18(23)25-21-22)12-20-11-10-13-2-4-14(19)5-3-13;/h2-9,20H,10-12H2,1H3;1H | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccc(cc3)F.Cl | |
| AKOS005253461 | 419.43 | C18 H18 F N5 O4 S | OJZMFOFRVGHILH-UHFFFAOYSA-N | InChI=1S/C18H18FN5O4S/c1-22-14(17(27)28-21-22)9-23-13(16(26)24(18(23)29)12-6-7-12)8-15(25)20-11-4-2-10(19)3-5-11/h2-5,12-13H,6-9H2,1H3,(H-,20,21,25,27) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C3CC3)CC(=O)Nc4ccc(cc4)F | |
| AKOS005253460 | 473.426 | C18 H18 F3 N5 O5 S | WGYRUNOWYBWMOR-UHFFFAOYSA-N | InChI=1S/C18H18F3N5O5S/c1-3-25-15(28)12(26(17(25)32)9-13-16(29)31-23-24(13)2)8-14(27)22-10-4-6-11(7-5-10)30-18(19,20)21/h4-7,12H,3,8-9H2,1-2H3,(H-,22,23,27,29) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)OC(F)(F)F | |
| AKOS005253502 | 527.336 | C18 H18 I N5 O4 S | ZBHVGADBSYPFLP-UHFFFAOYSA-N | InChI=1S/C18H18IN5O4S/c1-22-14(17(27)28-21-22)9-23-13(16(26)24(18(23)29)12-6-7-12)8-15(25)20-11-4-2-10(19)3-5-11/h2-5,12-13H,6-9H2,1H3,(H-,20,21,25,27) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C3CC3)CC(=O)Nc4ccc(cc4)I | |
| AKOS005219837 | 354.426 | C18 H18 N4 O2 S | CTADCVFMBXMACF-UHFFFAOYSA-N | InChI=1S/C18H18N4O2S/c1-21-16(17(23)24-20-21)13-22(12-14-8-4-2-5-9-14)18(25)19-15-10-6-3-7-11-15/h2-11H,12-13H2,1H3,(H-,19,20,23,25) | C[n+]1c(c(on1)[O-])CN(Cc2ccccc2)C(=S)Nc3ccccc3 | |
| AKOS005250085 | 354.426 | C18 H18 N4 O2 S | ZMURPFYXCDTIBY-UHFFFAOYSA-N | InChI=1S/C18H18N4O2S/c1-19-18(25)21(12-14-8-4-2-5-9-14)13-16-17(23)24-20-22(16)15-10-6-3-7-11-15/h2-11H,12-13H2,1H3,(H-,19,20,23,25) | CNC(=S)N(Cc1ccccc1)Cc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005219869 | 370.426 | C18 H18 N4 O3 S | VEVUDLUMYUGYGK-UHFFFAOYSA-N | InChI=1S/C18H18N4O3S/c1-21(18(26)19-13-6-4-3-5-7-13)12-16-17(23)25-20-22(16)14-8-10-15(24-2)11-9-14/h3-11H,12H2,1-2H3,(H-,19,20,23,26) | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=S)Nc3ccccc3 | |
| AKOS005219886 | 370.426 | C18 H18 N4 O3 S | BLUGXCNEFSPLFT-UHFFFAOYSA-N | InChI=1S/C18H18N4O3S/c23-12-11-21(18(26)19-14-7-3-1-4-8-14)13-16-17(24)25-20-22(16)15-9-5-2-6-10-15/h1-10,23H,11-13H2,(H-,19,20,24,26) | c1ccc(cc1)NC(=S)N(CCO)Cc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252012 | 434.489 | C18 H18 N4 O5 S2 | VYALXYKIAAHWQL-UHFFFAOYSA-N | InChI=1S/C18H18N4O5S2/c1-2-15(16(23)20-12-8-10-14(11-9-12)29(19,25)26)28-17-18(24)27-21-22(17)13-6-4-3-5-7-13/h3-11,15H,2H2,1H3,(H3-,19,20,21,23,24,25,26) | CCC(C(=O)Nc1ccc(cc1)S(=O)(=O)N)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250652 | 418.424 | C18 H18 N4 O6 S | VFLGKUTULIFAGJ-UHFFFAOYSA-N | InChI=1S/C18H18N4O6S/c1-27-14-6-4-13(5-7-14)22-16(18(24)28-21-22)17(23)20-11-10-12-2-8-15(9-3-12)29(19,25)26/h2-9H,10-11H2,1H3,(H3-,19,20,21,23,24,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCCc3ccc(cc3)S(=O)(=O)N | |
| AKOS005251839 | 450.489 | C18 H18 N4 O6 S2 | AQZLQSQNSRWVIZ-UHFFFAOYSA-N | InChI=1S/C18H18N4O6S2/c1-11(16(23)20-12-3-9-15(10-4-12)30(19,25)26)29-17-18(24)28-21-22(17)13-5-7-14(27-2)8-6-13/h3-11H,1-2H3,(H3-,19,20,21,23,24,25,26) | CC(C(=O)Nc1ccc(cc1)S(=O)(=O)N)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252238 | 450.489 | C18 H18 N4 O6 S2 | XJGTXBQCUFQWPZ-UHFFFAOYSA-N | InChI=1S/C18H18N4O6S2/c1-27-14-6-4-13(5-7-14)22-17(18(24)28-21-22)29-11-10-16(23)20-12-2-8-15(9-3-12)30(19,25)26/h2-9H,10-11H2,1H3,(H3-,19,20,21,23,24,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)S(=O)(=O)N | |
| AKOS005250590 | 382.373 | C18 H18 N6 O4 | DWNPRLBFYBFMID-UHFFFAOYSA-N | InChI=1S/C18H18N6O4/c1-27-14-5-3-13(4-6-14)24-15(17(26)28-21-24)16(25)22-9-11-23(12-10-22)18-19-7-2-8-20-18/h2-8H,9-12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)c4ncccn4 | |
| AKOS005253517 | 446.437 | C18 H18 N6 O6 S | MISJJDGQKMCHEK-UHFFFAOYSA-N | InChI=1S/C18H18N6O6S/c1-21-14(17(27)30-20-21)9-22-13(16(26)23(18(22)31)11-6-7-11)8-15(25)19-10-2-4-12(5-3-10)24(28)29/h2-5,11,13H,6-9H2,1H3,(H-,19,20,25,27) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C3CC3)CC(=O)Nc4ccc(cc4)N(=O)=O | |
| AKOS005253159 | 410.453 | C18 H18 N8 O2 S | KIIVIBXJGPYFOM-UHFFFAOYSA-N | InChI=1S/C18H18N8O2S/c27-14(20-15-10-26(24-28-15)25-8-4-1-5-9-25)11-29-18-21-17-16(22-23-18)12-6-2-3-7-13(12)19-17/h2-3,6-7,10H,1,4-5,8-9,11H2,(H-,19,20,21,22,23,24,27) | c1ccc2c(c1)c3c([nH]2)nc(nn3)SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005252964 | 426.452 | C18 H18 N8 O3 S | JAUFEGRVLSXLAA-UHFFFAOYSA-N | InChI=1S/C18H18N8O3S/c19-7-12-16(11-1-2-11)13(8-20)18(23-17(12)21)30-10-14(27)22-15-9-26(24-29-15)25-3-5-28-6-4-25/h9,11H,1-6,10H2,(H2-,21,22,23,24,27) | c1c(on[n+]1N2CCOCC2)[N-]C(=O)CSc3c(c(c(c(n3)N)C#N)C4CC4)C#N | |
| AKOS005214702 | 309.362 | C18 H19 N3 O2 | PSZILPCOTAWIRI-UHFFFAOYSA-N | InChI=1S/C18H19N3O2/c1-13-8-10-16(11-9-13)21-17(18(22)23-20-21)12-19-14(2)15-6-4-3-5-7-15/h3-11,14,19H,12H2,1-2H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNC(C)c3ccccc3 | |
| AKOS005214703 | 309.362 | C18 H19 N3 O2 | HVKLGAFHLUTXKA-UHFFFAOYSA-N | InChI=1S/C18H19N3O2/c1-13-3-7-15(8-4-13)11-19-12-17-18(22)23-20-21(17)16-9-5-14(2)6-10-16/h3-10,19H,11-12H2,1-2H3 | Cc1ccc(cc1)CNCc2c(on[n+]2c3ccc(cc3)C)[O-] | |
| AKOS005214704 | 309.362 | C18 H19 N3 O2 | OOUHNZWUQFOXLR-UHFFFAOYSA-N | InChI=1S/C18H19N3O2/c1-14-7-9-16(10-8-14)21-17(18(22)23-20-21)13-19-12-11-15-5-3-2-4-6-15/h2-10,19H,11-13H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccccc3 | |
| AKOS005214700 | 325.362 | C18 H19 N3 O3 | KYWLWMUWBSHMQV-UHFFFAOYSA-N | InChI=1S/C18H19N3O3/c1-13(14-6-4-3-5-7-14)19-12-17-18(22)24-20-21(17)15-8-10-16(23-2)11-9-15/h3-11,13,19H,12H2,1-2H3 | CC(c1ccccc1)NCc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005214701 | 325.362 | C18 H19 N3 O3 | HMBDFIIPWZZXOL-UHFFFAOYSA-N | InChI=1S/C18H19N3O3/c1-13-3-5-14(6-4-13)11-19-12-17-18(22)24-20-21(17)15-7-9-16(23-2)10-8-15/h3-10,19H,11-12H2,1-2H3 | Cc1ccc(cc1)CNCc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005214710 | 325.362 | C18 H19 N3 O3 | SQAVTVLQHGEKRA-UHFFFAOYSA-N | InChI=1S/C18H19N3O3/c1-23-16-9-7-15(8-10-16)21-17(18(22)24-20-21)13-19-12-11-14-5-3-2-4-6-14/h2-10,19H,11-13H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccccc3 | |
| AKOS005214771 | 325.362 | C18 H19 N3 O3 | DXIFJXLFZFASIC-UHFFFAOYSA-N | InChI=1S/C18H19N3O3/c1-23-16-9-7-14(8-10-16)11-12-19-13-17-18(22)24-20-21(17)15-5-3-2-4-6-15/h2-10,19H,11-13H2,1H3 | COc1ccc(cc1)CCNCc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005214792 | 325.362 | C18 H19 N3 O3 | PTCHOOGWFCBKKA-UHFFFAOYSA-N | InChI=1S/C18H19N3O3/c1-23-17-10-6-5-7-14(17)11-12-19-13-16-18(22)24-20-21(16)15-8-3-2-4-9-15/h2-10,19H,11-13H2,1H3 | COc1ccccc1CCNCc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005215572 | 361.823 | C18 H19 N3 O3 . Cl H | YOWWYRLTEDLJTN-UHFFFAOYSA-N | InChI=1S/C18H19N3O3.ClH/c1-13-3-5-14(6-4-13)11-19-12-17-18(22)24-20-21(17)15-7-9-16(23-2)10-8-15;/h3-10,19H,11-12H2,1-2H3;1H | Cc1ccc(cc1)CNCc2c(on[n+]2c3ccc(cc3)OC)[O-].Cl | |
| AKOS005215584 | 389.426 | C18 H19 N3 O5 S | JIQMKPSWEWWSBW-UHFFFAOYSA-N | InChI=1S/C18H19N3O5S/c1-13-4-10-16(11-5-13)27(23,24)20(2)12-17-18(22)26-19-21(17)14-6-8-15(25-3)9-7-14/h4-11H,12H2,1-3H3 | Cc1ccc(cc1)S(=O)(=O)N(C)Cc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005253129 | 401.506 | C18 H19 N5 O2 S2 | CHVWLFWNAIWTBA-UHFFFAOYSA-N | InChI=1S/C18H19N5O2S2/c24-16(20-17-11-23(21-25-17)22-9-5-2-6-10-22)13-27-18-19-15(12-26-18)14-7-3-1-4-8-14/h1,3-4,7-8,11-12H,2,5-6,9-10,13H2 | c1ccc(cc1)c2csc(n2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4 | |
| AKOS005252794 | 385.44 | C18 H19 N5 O3 S | NVROSDQDZIMKAO-UHFFFAOYSA-N | InChI=1S/C18H19N5O3S/c1-11(2)22-9-16(26-21-22)20-15(24)10-27-18-19-14-6-4-3-5-13(14)17(25)23(18)12-7-8-12/h3-6,9,11-12H,7-8,10H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3c(=O)n2C4CC4 | |
| AKOS005253016 | 417.505 | C18 H19 N5 O3 S2 | IJGUPOXXENNVAG-UHFFFAOYSA-N | InChI=1S/C18H19N5O3S2/c1-13-2-4-14(5-3-13)15-11-27-18(19-15)28-12-16(24)20-17-10-23(21-26-17)22-6-8-25-9-7-22/h2-5,10-11H,6-9,12H2,1H3 | Cc1ccc(cc1)c2csc(n2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4 | |
| AKOS005253368 | 401.44 | C18 H19 N5 O4 S | JBJKNOSKMOPGDX-UHFFFAOYSA-N | InChI=1S/C18H19N5O4S/c1-26-9-8-22-10-16(27-21-22)20-15(24)11-28-18-19-14-5-3-2-4-13(14)17(25)23(18)12-6-7-12/h2-5,10,12H,6-9,11H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3c(=O)n2C4CC4 | |
| AKOS005253446 | 401.44 | C18 H19 N5 O4 S | DAWRHOXGBWGBIZ-UHFFFAOYSA-N | InChI=1S/C18H19N5O4S/c1-21-14(17(26)27-20-21)10-22-13(16(25)23(18(22)28)12-7-8-12)9-15(24)19-11-5-3-2-4-6-11/h2-6,12-13H,7-10H2,1H3,(H-,19,20,24,26) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C3CC3)CC(=O)Nc4ccccc4 | |
| AKOS005253390 | 433.505 | C18 H19 N5 O4 S2 | XPJFMBXMWUATFY-UHFFFAOYSA-N | InChI=1S/C18H19N5O4S2/c1-25-14-4-2-13(3-5-14)15-11-28-18(19-15)29-12-16(24)20-17-10-23(21-27-17)22-6-8-26-9-7-22/h2-5,10-11H,6-9,12H2,1H3 | COc1ccc(cc1)c2csc(n2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4 | |
| AKOS005251338 | 385.374 | C18 H19 N5 O5 | WYCPDXJENOKTJZ-UHFFFAOYSA-N | InChI=1S/C18H19N5O5/c1-21-14(18(27)28-20-21)9-22(11-6-7-11)13-8-15(24)23(17(13)26)12-4-2-10(3-5-12)16(19)25/h2-5,11,13H,6-9H2,1H3,(H2-,19,20,25,27) | C[n+]1c(c(on1)[O-])CN(C2CC2)C3CC(=O)N(C3=O)c4ccc(cc4)C(=O)N | |
| AKOS005253481 | 417.439 | C18 H19 N5 O5 S | QNKMRCBHGYUTEX-UHFFFAOYSA-N | InChI=1S/C18H19N5O5S/c1-10(24)11-4-6-12(7-5-11)19-15(25)8-13-16(26)21(2)18(29)23(13)9-14-17(27)28-20-22(14)3/h4-7,13H,8-9H2,1-3H3,(H-,19,20,24,25,27) | CC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])C | |
| AKOS005253482 | 433.438 | C18 H19 N5 O6 S | SFUYTPZFSCCGBI-UHFFFAOYSA-N | InChI=1S/C18H19N5O6S/c1-21-15(25)12(23(18(21)30)9-13-17(27)29-20-22(13)2)8-14(24)19-11-6-4-10(5-7-11)16(26)28-3/h4-7,12H,8-9H2,1-3H3,(H-,19,20,24,26,27) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C)CC(=O)Nc3ccc(cc3)C(=O)OC | |
| AKOS005250918 | 356.376 | C18 H20 N4 O4 | CHLGSULVJGWWHU-UHFFFAOYSA-O | InChI=1S/C18H19N4O4/c1-21-15(18(25)26-20-21)12-14(17(24)22-10-6-3-7-11-22)19-16(23)13-8-4-2-5-9-13/h2,4-5,8-9,12H,3,6-7,10-11H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCCCC2)\NC(=O)c3ccccc3 | |
| AKOS005250919 | 356.376 | C18 H20 N4 O4 | VTLXXDAAFILECY-UHFFFAOYSA-O | InChI=1S/C18H19N4O4/c1-22-15(18(25)26-21-22)11-14(17(24)19-13-9-5-6-10-13)20-16(23)12-7-3-2-4-8-12/h2-4,7-8,11,13H,5-6,9-10H2,1H3,(H,19,24)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NC2CCCC2)\NC(=O)c3ccccc3 | |
| AKOS005251304 | 356.376 | C18 H20 N4 O4 | GRYYYNPJBJHPNU-UHFFFAOYSA-N | InChI=1S/C18H20N4O4/c1-11-3-5-13(6-4-11)22-16(23)9-14(17(22)24)21(12-7-8-12)10-15-18(25)26-19-20(15)2/h3-6,12,14H,7-10H2,1-2H3 | Cc1ccc(cc1)N2C(=O)CC(C2=O)N(Cc3c(on[n+]3C)[O-])C4CC4 | |
| AKOS005214755 | 388.441 | C18 H20 N4 O4 S | WMGOJFKZUICGBA-UHFFFAOYSA-N | InChI=1S/C18H20N4O4S/c1-13-2-6-15(7-3-13)22-17(18(23)26-21-22)12-20-11-10-14-4-8-16(9-5-14)27(19,24)25/h2-9,20H,10-12H2,1H3,(H2-,19,21,23,24,25) | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccc(cc3)S(=O)(=O)N | |
| AKOS005250913 | 372.375 | C18 H20 N4 O5 | SFIDFCNJFOZANZ-UHFFFAOYSA-O | InChI=1S/C18H19N4O5/c1-22-15(18(25)27-21-22)10-14(17(24)19-11-13-8-5-9-26-13)20-16(23)12-6-3-2-4-7-12/h2-4,6-7,10,13H,5,8-9,11H2,1H3,(H,19,24)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCC2CCCO2)\NC(=O)c3ccccc3 | |
| AKOS005250949 | 372.375 | C18 H20 N4 O5 | VOOITVLEAMAQJS-UHFFFAOYSA-O | InChI=1S/C18H19N4O5/c1-21-15(18(26)27-20-21)11-14(17(25)22-9-7-13(23)8-10-22)19-16(24)12-5-3-2-4-6-12/h2-6,11,13,23H,7-10H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCC(CC2)O)\NC(=O)c3ccccc3 | |
| AKOS005251319 | 372.375 | C18 H20 N4 O5 | IBOFMPPKLKJPRF-UHFFFAOYSA-N | InChI=1S/C18H20N4O5/c1-20-15(18(25)27-19-20)10-21(11-3-4-11)14-9-16(23)22(17(14)24)12-5-7-13(26-2)8-6-12/h5-8,11,14H,3-4,9-10H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C2CC2)C3CC(=O)N(C3=O)c4ccc(cc4)OC | |
| AKOS005214762 | 404.44 | C18 H20 N4 O5 S | KWHMICQXOIJMTL-UHFFFAOYSA-N | InChI=1S/C18H20N4O5S/c1-26-15-6-4-14(5-7-15)22-17(18(23)27-21-22)12-20-11-10-13-2-8-16(9-3-13)28(19,24)25/h2-9,20H,10-12H2,1H3,(H2-,19,21,23,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccc(cc3)S(=O)(=O)N | |
| AKOS005219844 | 388.375 | C18 H20 N4 O6 | DHQFSMIZFIBRLF-UHFFFAOYSA-N | InChI=1S/C18H20N4O6/c1-11(23)12-3-5-13(6-4-12)19-16(24)9-15-17(25)22(7-8-27-15)10-14-18(26)28-20-21(14)2/h3-6,15H,7-10H2,1-2H3,(H-,19,20,23,24,26) | CC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3C)[O-] | |
| AKOS005251296 | 388.375 | C18 H20 N4 O6 | GZHOIRQHKUEDFT-UHFFFAOYSA-N | InChI=1S/C18H20N4O6/c1-4-27-17(25)11-5-7-12(8-6-11)22-15(23)9-13(16(22)24)20(2)10-14-18(26)28-19-21(14)3/h5-8,13H,4,9-10H2,1-3H3 | CCOC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)N(C)Cc3c(on[n+]3C)[O-] | |
| AKOS005219814 | 404.374 | C18 H20 N4 O7 | ZYJWSDQYFOYVBQ-UHFFFAOYSA-N | InChI=1S/C18H20N4O7/c1-21-13(18(26)29-20-21)10-22-7-8-28-14(16(22)24)9-15(23)19-12-5-3-11(4-6-12)17(25)27-2/h3-6,14H,7-10H2,1-2H3,(H-,19,20,23,25,26) | C[n+]1c(c(on1)[O-])CN2CCOC(C2=O)CC(=O)Nc3ccc(cc3)C(=O)OC | |
| AKOS005253152 | 384.455 | C18 H20 N6 O2 S | HAUTXJKFNFYGGT-UHFFFAOYSA-N | InChI=1S/C18H20N6O2S/c19-10-14-9-13-5-4-6-15(13)20-18(14)27-12-16(25)21-17-11-24(22-26-17)23-7-2-1-3-8-23/h9,11H,1-8,12H2 | c1c2c(nc(c1C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)CCC2 | |
| AKOS005253029 | 400.455 | C18 H20 N6 O3 S | CVVKZTIWQNBPKJ-UHFFFAOYSA-N | InChI=1S/C18H20N6O3S/c19-10-14-9-13-3-1-2-4-15(13)20-18(14)28-12-16(25)21-17-11-24(22-27-17)23-5-7-26-8-6-23/h9,11H,1-8,12H2 | c1c2c(nc(c1C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)CCCC2 | |
| AKOS005253150 | 400.455 | C18 H20 N6 O3 S | ZFLULJRNYRGNTP-UHFFFAOYSA-N | InChI=1S/C18H20N6O3S/c1-22-17(26)13-7-3-4-8-14(13)19-18(22)28-12-15(25)20-16-11-24(21-27-16)23-9-5-2-6-10-23/h3-4,7-8,11H,2,5-6,9-10,12H2,1H3 | Cn1c(=O)c2ccccc2nc1SCC(=O)[N-]c3c[n+](no3)N4CCCCC4 | |
| AKOS005253027 | 416.454 | C18 H20 N6 O4 S | FEKBDDKSNVWMND-UHFFFAOYSA-N | InChI=1S/C18H20N6O4S/c1-2-23-17(26)13-5-3-4-6-14(13)19-18(23)29-12-15(25)20-16-11-24(21-28-16)22-7-9-27-10-8-22/h3-6,11H,2,7-10,12H2,1H3 | CCn1c(=O)c2ccccc2nc1SCC(=O)[N-]c3c[n+](no3)N4CCOCC4 | |
| AKOS005252939 | 432.454 | C18 H20 N6 O5 S | ROSBCDFOQSGGTI-UHFFFAOYSA-N | InChI=1S/C18H20N6O5S/c1-3-28-18(26)13-8-12(2)20-17(14(13)9-19)30-11-15(25)21-16-10-24(22-29-16)23-4-6-27-7-5-23/h8,10H,3-7,11H2,1-2H3 | CCOC(=O)c1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3)C | |
| AKOS005253475 | 432.454 | C18 H20 N6 O5 S | PKAJPWRDBLGGDM-UHFFFAOYSA-N | InChI=1S/C18H20N6O5S/c1-3-23-16(27)12(24(18(23)30)9-13-17(28)29-21-22(13)2)8-14(25)20-11-6-4-10(5-7-11)15(19)26/h4-7,12H,3,8-9H2,1-2H3,(H3-,19,20,21,25,26,28) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)C(=O)N | |
| AKOS005253490 | 432.454 | C18 H20 N6 O5 S | OTZIKNKPDYUZEK-UHFFFAOYSA-N | InChI=1S/C18H20N6O5S/c1-10(25)19-11-4-6-12(7-5-11)20-15(26)8-13-16(27)22(2)18(30)24(13)9-14-17(28)29-21-23(14)3/h4-7,13,21,28H,8-9H2,1-3H3 | CC(=O)Nc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])C | |
| AKOS005253462 | 480.518 | C18 H20 N6 O6 S2 | YWUMEIZZHJKFOD-UHFFFAOYSA-N | InChI=1S/C18H20N6O6S2/c1-22-14(17(27)30-21-22)9-23-13(16(26)24(18(23)31)11-4-5-11)8-15(25)20-10-2-6-12(7-3-10)32(19,28)29/h2-3,6-7,11,13H,4-5,8-9H2,1H3,(H3-,19,20,21,25,27,28,29) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C3CC3)CC(=O)Nc4ccc(cc4)S(=O)(=O)N | |
| AKOS005253011 | 428.468 | C18 H20 N8 O3 S | DVKBRGWMEURRTC-UHFFFAOYSA-N | InChI=1S/C18H20N8O3S/c1-11(2)16-12(7-19)17(21)23-18(13(16)8-20)30-10-14(27)22-15-9-26(24-29-15)25-3-5-28-6-4-25/h9,11H,3-6,10H2,1-2H3,(H2-,21,22,23,24,27) | CC(C)c1c(c(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3)N)C#N | |
| AKOS005219561 | 391.508 | C18 H21 N3 O3 S2 | COGOTMKNRCEIHH-UHFFFAOYSA-N | InChI=1S/C18H21N3O3S2/c1-12-7-6-8-13(2)20(12)18(25)26-11-15(22)16-17(23)24-19-21(16)14-9-4-3-5-10-14/h3-5,9-10,12-13H,6-8,11H2,1-2H3 | CC1CCCC(N1C(=S)SCC(=O)c2c(on[n+]2c3ccccc3)[O-])C | |
| AKOS005250165 | 343.377 | C18 H21 N3 O4 | YDYUPKBZLVSFJE-UHFFFAOYSA-N | InChI=1S/C18H21N3O4/c1-24-15-9-7-14(8-10-15)21-16(18(23)25-20-21)17(22)19-12-11-13-5-3-2-4-6-13/h5,7-10H,2-4,6,11-12H2,1H3,(H-,19,20,22,23) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCCC3=CCCCC3 | |
| AKOS005250314 | 343.377 | C18 H21 N3 O4 | IKPFOGVIFZKXKC-UHFFFAOYSA-N | InChI=1S/C18H21N3O4/c1-24-15-9-7-14(8-10-15)21-16(18(23)25-19-21)11-20(13-5-6-13)17(22)12-3-2-4-12/h7-10,12-13H,2-6,11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)C4CCC4 | |
| AKOS005219565 | 407.507 | C18 H21 N3 O4 S2 | IVVRGRFFGWJLOV-UHFFFAOYSA-N | InChI=1S/C18H21N3O4S2/c1-12-5-3-4-10-20(12)18(26)27-11-15(22)16-17(23)25-19-21(16)13-6-8-14(24-2)9-7-13/h6-9,12H,3-5,10-11H2,1-2H3 | CC1CCCCN1C(=S)SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250604 | 375.376 | C18 H21 N3 O6 | CRNXTYXVBDCJQQ-UHFFFAOYSA-N | InChI=1S/C18H21N3O6/c1-3-26-17(23)12-8-10-20(11-9-12)16(22)15-18(24)27-19-21(15)13-4-6-14(25-2)7-5-13/h4-7,12H,3,8-11H2,1-2H3 | CCOC(=O)C1CCN(CC1)C(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250627 | 375.376 | C18 H21 N3 O6 | LVLKCGBKGTWQOU-UHFFFAOYSA-N | InChI=1S/C18H21N3O6/c1-3-26-17(23)12-5-4-10-20(11-12)16(22)15-18(24)27-19-21(15)13-6-8-14(25-2)9-7-13/h6-9,12H,3-5,10-11H2,1-2H3 | CCOC(=O)C1CCCN(C1)C(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252492 | 371.457 | C18 H21 N5 O2 S | VRGFKXDQNCKLRN-UHFFFAOYSA-N | InChI=1S/C18H21N5O2S/c1-2-23-11-17(25-22-23)21-16(24)12-26-18-14(10-19)9-13-7-5-3-4-6-8-15(13)20-18/h9,11H,2-8,12H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCCCCC3)C#N | |
| AKOS005252842 | 371.457 | C18 H21 N5 O2 S | BCONMOWXZKDCAD-UHFFFAOYSA-N | InChI=1S/C18H21N5O2S/c1-12(2)23-10-17(25-22-23)21-16(24)11-26-18-14(9-19)8-13-6-4-3-5-7-15(13)20-18/h8,10,12H,3-7,11H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCCCC3)C#N | |
| AKOS005252851 | 371.457 | C18 H21 N5 O2 S | PFVFVMZMTFSQON-UHFFFAOYSA-N | InChI=1S/C18H21N5O2S/c1-11(2)23-9-17(25-22-23)21-16(24)10-26-18-14(8-19)7-13-6-12(3)4-5-15(13)20-18/h7,9,11-12H,4-6,10H2,1-3H3 | CC1CCc2c(cc(c(n2)SCC(=O)[N-]c3c[n+](no3)C(C)C)C#N)C1 | |
| AKOS005253292 | 387.456 | C18 H21 N5 O3 S | HRDGJKNRTGXHMO-UHFFFAOYSA-N | InChI=1S/C18H21N5O3S/c1-25-8-7-23-11-17(26-22-23)21-16(24)12-27-18-14(10-19)9-13-5-3-2-4-6-15(13)20-18/h9,11H,2-8,12H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCCCC3)C#N | |
| AKOS005253396 | 387.456 | C18 H21 N5 O3 S | FINGHCIXEOWYLC-UHFFFAOYSA-N | InChI=1S/C18H21N5O3S/c1-12-3-4-15-13(7-12)8-14(9-19)18(20-15)27-11-16(24)21-17-10-23(22-26-17)5-6-25-2/h8,10,12H,3-7,11H2,1-2H3 | CC1CCc2c(cc(c(n2)SCC(=O)[N-]c3c[n+](no3)CCOC)C#N)C1 | |
| AKOS005250924 | 371.39 | C18 H21 N5 O4 | FGDUZRPCAJOUJO-UHFFFAOYSA-O | InChI=1S/C18H20N5O4/c1-21-8-10-23(11-9-21)17(25)14(12-15-18(26)27-20-22(15)2)19-16(24)13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCN(CC2)C)\NC(=O)c3ccccc3 | |
| AKOS005251367 | 371.39 | C18 H21 N5 O4 | NGAXAHOGNWHAER-UHFFFAOYSA-O | InChI=1S/C18H20N5O4/c1-22-15(18(26)27-21-22)12-14(17(25)20-23-10-6-3-7-11-23)19-16(24)13-8-4-2-5-9-13/h2,4-5,8-9,12H,3,6-7,10-11H2,1H3,(H,20,25)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NN2CCCCC2)\NC(=O)c3ccccc3 | |
| AKOS005253452 | 403.455 | C18 H21 N5 O4 S | CCFXCDBVQGRUMT-UHFFFAOYSA-N | InChI=1S/C18H21N5O4S/c1-4-22-16(25)13(9-15(24)19-12-7-5-11(2)6-8-12)23(18(22)28)10-14-17(26)27-20-21(14)3/h5-8,13H,4,9-10H2,1-3H3,(H-,19,20,24,26) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)C | |
| AKOS005253459 | 419.455 | C18 H21 N5 O5 S | LBDNJYAEFQRBFR-UHFFFAOYSA-N | InChI=1S/C18H21N5O5S/c1-4-22-16(25)13(9-15(24)19-11-5-7-12(27-3)8-6-11)23(18(22)29)10-14-17(26)28-20-21(14)2/h5-8,13H,4,9-10H2,1-3H3,(H-,19,20,24,26) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)OC | |
| AKOS005253466 | 419.455 | C18 H21 N5 O5 S | VPDZHESKWQYSSY-UHFFFAOYSA-N | InChI=1S/C18H21N5O5S/c1-4-27-12-7-5-11(6-8-12)19-15(24)9-13-16(25)21(2)18(29)23(13)10-14-17(26)28-20-22(14)3/h5-8,13H,4,9-10H2,1-3H3,(H-,19,20,24,26) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])C | |
| AKOS005251563 | 451.52 | C18 H21 N5 O5 S2 | ABGKTMINBIHELE-UHFFFAOYSA-N | InChI=1S/C18H21N5O5S2/c1-18(2,3)27-17(26)23-6-5-10-11(7-19)14(30-12(10)8-23)20-13(24)9-29-15-16(25)28-21-22(15)4/h5-6,8-9H2,1-4H3,(H-,20,21,24,25) | CC(C)(C)OC(=O)N1CCc2c(sc(c2C#N)NC(=O)CSc3c(on[n+]3C)[O-])C1 | |
| AKOS005250351 | 403.389 | C18 H21 N5 O6 | DEGRXYNRBOEZEB-UHFFFAOYSA-N | InChI=1S/C18H21N5O6/c1-11(24)19-12-3-5-13(6-4-12)20-16(25)9-15-17(26)23(7-8-28-15)10-14-18(27)29-21-22(14)2/h3-6,15,21,27H,7-10H2,1-2H3 | CC(=O)Nc1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3C)[O-] | |
| AKOS005253387 | 468.981 | C18 H21 N6 O3 S2 . Cl | KBRYLZXHQLCBLB-UHFFFAOYSA-N | InChI=1S/C18H20N6O3S2.ClH/c19-9-14-12-3-1-2-4-13(12)18(29-17(14)20)28-11-15(25)21-16-10-24(22-27-16)23-5-7-26-8-6-23;/h10,20H,1-8,11H2;1H | c1c(on[n+]1N2CCOCC2)[N-]C(=O)CSc3c4c(c(c([s+]3)N)C#N)CCCC4.[Cl-] | |
| AKOS005219507 | 417.38 | C18 H22 F3 N3 O5 | XKJCTLLORIFVNO-UHFFFAOYSA-N | InChI=1S/C18H22F3N3O5/c1-10(2)24-13(14(25)11-6-8-12(9-7-11)18(19,20)21)15(28-23-24)22-29-16(26)27-17(3,4)5/h6-10,14,25H,1-5H3 | CC(C)[n+]1c(c(on1)[N-]OC(=O)OC(C)(C)C)C(c2ccc(cc2)C(F)(F)F)O | |
| AKOS005251568 | 406.522 | C18 H22 N4 O3 S2 | JYRFGLWLZFAARH-UHFFFAOYSA-N | InChI=1S/C18H22N4O3S2/c1-18(2,3)10-5-6-11-12(8-19)15(27-13(11)7-10)20-14(23)9-26-16-17(24)25-21-22(16)4/h10H,5-7,9H2,1-4H3,(H-,20,21,23,24) | CC(C)(C)C1CCc2c(sc(c2C#N)NC(=O)CSc3c(on[n+]3C)[O-])C1 | |
| AKOS005250897 | 358.392 | C18 H22 N4 O4 | UHDAMKWFSYBYEU-UHFFFAOYSA-O | InChI=1S/C18H21N4O4/c1-5-18(2,3)20-16(24)13(11-14-17(25)26-21-22(14)4)19-15(23)12-9-7-6-8-10-12/h6-11H,5H2,1-4H3,(H,20,24)/q-1/p+1 | CCC(C)(C)NC(=O)/C(=C/c1c(on[n+]1C)[O-])/NC(=O)c2ccccc2 | |
| AKOS005250482 | 374.391 | C18 H22 N4 O5 | NKINHZJYYVGNKJ-UHFFFAOYSA-N | InChI=1S/C18H22N4O5/c1-18(2,3)26-17(25)21-11-9-20(10-12-21)15(23)14-16(24)27-19-22(14)13-7-5-4-6-8-13/h4-8H,9-12H2,1-3H3 | CC(C)(C)OC(=O)N1CCN(CC1)C(=O)c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250951 | 374.391 | C18 H22 N4 O5 | DIDOYUPPLLKCQA-UHFFFAOYSA-O | InChI=1S/C18H21N4O5/c1-3-26-11-7-10-19-17(24)14(12-15-18(25)27-21-22(15)2)20-16(23)13-8-5-4-6-9-13/h4-6,8-9,12H,3,7,10-11H2,1-2H3,(H,19,24)/q-1/p+1 | CCOCCCNC(=O)/C(=C/c1c(on[n+]1C)[O-])/NC(=O)c2ccccc2 | |
| AKOS005219842 | 390.39 | C18 H22 N4 O6 | HVDCDISMDPXSQR-UHFFFAOYSA-N | InChI=1S/C18H22N4O6/c1-20-15(18(26)28-19-20)9-22(12-6-7-12)16(23)10-21(11-17(24)25)13-4-3-5-14(8-13)27-2/h3-5,8,12H,6-7,9-11H2,1-2H3,(H-,19,24,25,26) | C[n+]1c(c(on1)[O-])CN(C2CC2)C(=O)CN(CC(=O)O)c3cccc(c3)OC | |
| AKOS005219861 | 390.39 | C18 H22 N4 O6 | LUBJSIBUFREOOO-UHFFFAOYSA-N | InChI=1S/C18H22N4O6/c1-3-26-13-6-4-12(5-7-13)19-16(23)10-15-17(24)22(8-9-27-15)11-14-18(25)28-20-21(14)2/h4-7,15H,3,8-11H2,1-2H3,(H-,19,20,23,25) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3C)[O-] | |
| AKOS005219893 | 390.39 | C18 H22 N4 O6 | KSFVWPSRGPTGDH-UHFFFAOYSA-N | InChI=1S/C18H22N4O6/c1-20-15(18(26)28-19-20)9-22(13-3-4-13)16(23)10-21(11-17(24)25)12-5-7-14(27-2)8-6-12/h5-8,13H,3-4,9-11H2,1-2H3,(H-,19,24,25,26) | C[n+]1c(c(on1)[O-])CN(C2CC2)C(=O)CN(CC(=O)O)c3ccc(cc3)OC | |
| AKOS005251753 | 454.52 | C18 H22 N4 O6 S2 | KYZWNLLKRMTJSZ-UHFFFAOYSA-N | InChI=1S/C18H22N4O6S2/c1-5-27-17(25)13-11-6-7-22(10(3)23)8-12(11)30-15(13)19-14(24)9(2)29-16-18(26)28-20-21(16)4/h9H,5-8H2,1-4H3,(H-,19,20,24,25,26) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3C)[O-])CN(CC2)C(=O)C | |
| AKOS005251947 | 454.52 | C18 H22 N4 O6 S2 | WLXPVJSWCTUJIB-UHFFFAOYSA-N | InChI=1S/C18H22N4O6S2/c1-5-11(30-16-18(26)28-20-21(16)3)14(24)19-15-13(17(25)27-4)10-6-7-22(9(2)23)8-12(10)29-15/h11H,5-8H2,1-4H3,(H-,19,20,24,25,26) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)C)C(=O)OC)Sc3c(on[n+]3C)[O-] | |
| AKOS005252543 | 454.52 | C18 H22 N4 O6 S2 | YPLWCDUPHXXWTP-UHFFFAOYSA-N | InChI=1S/C18H22N4O6S2/c1-4-27-17(25)14-11-5-7-22(10(2)23)9-12(11)30-15(14)19-13(24)6-8-29-16-18(26)28-20-21(16)3/h4-9H2,1-3H3,(H-,19,20,24,25,26) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3C)[O-])CN(CC2)C(=O)C | |
| AKOS005250616 | 438.455 | C18 H22 N4 O7 S | QIVHPGIWMBJDCF-UHFFFAOYSA-N | InChI=1S/C18H22N4O7S/c1-18(2,3)28-17(26)22-7-6-9-10(8-22)30-14(11(9)15(24)27-5)19-13(23)12-16(25)29-20-21(12)4/h6-8H2,1-5H3,(H-,19,20,23,24,25) | CC(C)(C)OC(=O)N1CCc2c(sc(c2C(=O)OC)NC(=O)c3c(on[n+]3C)[O-])C1 | |
| AKOS005252708 | 386.471 | C18 H22 N6 O2 S | MNKBTVOBMOXWKY-UHFFFAOYSA-N | InChI=1S/C18H22N6O2S/c1-23(2)24-11-17(26-22-24)21-16(25)12-27-18-14(10-19)9-13-7-5-3-4-6-8-15(13)20-18/h9,11H,3-8,12H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCCCCC3)C#N | |
| AKOS005253058 | 386.471 | C18 H22 N6 O2 S | ZPJSWCSEOQJBDB-UHFFFAOYSA-N | InChI=1S/C18H22N6O2S/c1-12-13(2)15(9-19)18(20-14(12)3)27-11-16(25)21-17-10-24(22-26-17)23-7-5-4-6-8-23/h10H,4-8,11H2,1-3H3 | Cc1c(c(c(nc1C)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3)C#N)C | |
| AKOS005253082 | 386.471 | C18 H22 N6 O2 S | UTBSBWQXCVHWIN-UHFFFAOYSA-N | InChI=1S/C18H22N6O2S/c1-13(2)15-7-6-14(10-19)18(20-15)27-12-16(25)21-17-11-24(22-26-17)23-8-4-3-5-9-23/h6-7,11,13H,3-5,8-9,12H2,1-2H3 | CC(C)c1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3)C#N | |
| AKOS005253089 | 386.471 | C18 H22 N6 O2 S | CQBQCOIYUWDQDL-UHFFFAOYSA-N | InChI=1S/C18H22N6O2S/c1-2-6-15-8-7-14(11-19)18(20-15)27-13-16(25)21-17-12-24(22-26-17)23-9-4-3-5-10-23/h7-8,12H,2-6,9-10,13H2,1H3 | CCCc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3)C#N | |
| AKOS005252969 | 402.471 | C18 H22 N6 O3 S | USGIFTHWKJOCLM-UHFFFAOYSA-N | InChI=1S/C18H22N6O3S/c1-13(2)9-15-4-3-14(10-19)18(20-15)28-12-16(25)21-17-11-24(22-27-17)23-5-7-26-8-6-23/h3-4,11,13H,5-9,12H2,1-2H3 | CC(C)Cc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3)C#N | |
| AKOS005252976 | 402.471 | C18 H22 N6 O3 S | BIYQGJBAPMSTCT-UHFFFAOYSA-N | InChI=1S/C18H22N6O3S/c1-2-3-4-15-6-5-14(11-19)18(20-15)28-13-16(25)21-17-12-24(22-27-17)23-7-9-26-10-8-23/h5-6,12H,2-4,7-10,13H2,1H3 | CCCCc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)N3CCOCC3)C#N | |
| AKOS005214834 | 313.394 | C18 H23 N3 O2 | XJVBFYOHWSGMCV-UHFFFAOYSA-N | InChI=1S/C18H23N3O2/c1-14-7-9-16(10-8-14)21-17(18(22)23-20-21)13-19-12-11-15-5-3-2-4-6-15/h5,7-10,19H,2-4,6,11-13H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCC3=CCCCC3 | |
| AKOS005214831 | 329.394 | C18 H23 N3 O3 | RSFZKPWFYVVFIX-UHFFFAOYSA-N | InChI=1S/C18H23N3O3/c1-23-16-9-7-15(8-10-16)21-17(18(22)24-20-21)13-19-12-11-14-5-3-2-4-6-14/h5,7-10,19H,2-4,6,11-13H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCC3=CCCCC3 | |
| AKOS005250340 | 329.394 | C18 H23 N3 O3 | QJAILHMZVSRRBM-UHFFFAOYSA-N | InChI=1S/C18H23N3O3/c1-18(2,3)11-16(22)20(13-9-10-13)12-15-17(23)24-19-21(15)14-7-5-4-6-8-14/h4-8,13H,9-12H2,1-3H3 | CC(C)(C)CC(=O)N(Cc1c(on[n+]1c2ccccc2)[O-])C3CC3 | |
| AKOS005250304 | 345.393 | C18 H23 N3 O4 | XQIXFZRKAHOKGA-UHFFFAOYSA-N | InChI=1S/C18H23N3O4/c1-3-4-5-17(22)20(13-6-7-13)12-16-18(23)25-19-21(16)14-8-10-15(24-2)11-9-14/h8-11,13H,3-7,12H2,1-2H3 | CCCCC(=O)N(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C3CC3 | |
| AKOS005250326 | 345.393 | C18 H23 N3 O4 | HZWOVZLRWUUWOH-UHFFFAOYSA-N | InChI=1S/C18H23N3O4/c1-20(17(22)13-6-4-3-5-7-13)12-16-18(23)25-19-21(16)14-8-10-15(24-2)11-9-14/h8-11,13H,3-7,12H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)C3CCCCC3 | |
| AKOS005250579 | 393.457 | C18 H23 N3 O5 S | WJWXGGUQPCQCFY-UHFFFAOYSA-N | InChI=1S/C18H23N3O5S/c1-18(2,3)9-6-7-10-11(8-9)27-15(12(10)16(23)25-5)19-14(22)13-17(24)26-20-21(13)4/h9H,6-8H2,1-5H3,(H-,19,20,22,23,24) | CC(C)(C)C1CCc2c(sc(c2C(=O)OC)NC(=O)c3c(on[n+]3C)[O-])C1 | |
| AKOS005251914 | 393.457 | C18 H23 N3 O5 S | IVHZGMFDKSQKSO-UHFFFAOYSA-N | InChI=1S/C18H23N3O5S/c1-4-6-11-25-17(23)12-7-9-13(10-8-12)19-15(22)14(5-2)27-16-18(24)26-20-21(16)3/h7-10,14H,4-6,11H2,1-3H3,(H-,19,20,22,23,24) | CCCCOC(=O)c1ccc(cc1)NC(=O)C(CC)Sc2c(on[n+]2C)[O-] | |
| AKOS005251585 | 425.522 | C18 H23 N3 O5 S2 | OMJWAIPCVOHSRK-UHFFFAOYSA-N | InChI=1S/C18H23N3O5S2/c1-3-25-17(23)14-11-8-6-4-5-7-9-12(11)28-15(14)19-13(22)10-27-16-18(24)26-20-21(16)2/h3-10H2,1-2H3,(H-,19,20,22,23,24) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3C)[O-])CCCCCC2 | |
| AKOS005251750 | 425.522 | C18 H23 N3 O5 S2 | XELJPCSLHXARMF-UHFFFAOYSA-N | InChI=1S/C18H23N3O5S2/c1-5-25-17(23)13-11-7-6-9(2)8-12(11)28-15(13)19-14(22)10(3)27-16-18(24)26-20-21(16)4/h9-10H,5-8H2,1-4H3,(H-,19,20,22,23,24) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3C)[O-])CC(CC2)C | |
| AKOS005251848 | 425.522 | C18 H23 N3 O5 S2 | UYPKSHLWVNWNDE-UHFFFAOYSA-N | InChI=1S/C18H23N3O5S2/c1-4-25-17(23)13-11-8-6-5-7-9-12(11)28-15(13)19-14(22)10(2)27-16-18(24)26-20-21(16)3/h10H,4-9H2,1-3H3,(H-,19,20,22,23,24) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3C)[O-])CCCCC2 | |
| AKOS005251849 | 425.522 | C18 H23 N3 O5 S2 | HTQZIFTWCGVPQA-UHFFFAOYSA-N | InChI=1S/C18H23N3O5S2/c1-10(27-16-18(24)26-20-21(16)2)14(22)19-15-13(17(23)25-3)11-8-6-4-5-7-9-12(11)28-15/h10H,4-9H2,1-3H3,(H-,19,20,22,23,24) | CC(C(=O)Nc1c(c2c(s1)CCCCCC2)C(=O)OC)Sc3c(on[n+]3C)[O-] | |
| AKOS005251931 | 425.522 | C18 H23 N3 O5 S2 | AWWCGFPVDZWMKC-UHFFFAOYSA-N | InChI=1S/C18H23N3O5S2/c1-4-11(28-16-18(24)26-20-21(16)3)14(22)19-15-13(17(23)25-5-2)10-8-6-7-9-12(10)27-15/h11H,4-9H2,1-3H3,(H-,19,20,22,23,24) | CCC(C(=O)Nc1c(c2c(s1)CCCC2)C(=O)OCC)Sc3c(on[n+]3C)[O-] | |
| AKOS005251959 | 425.522 | C18 H23 N3 O5 S2 | XSRLOBSNYKHYRX-UHFFFAOYSA-N | InChI=1S/C18H23N3O5S2/c1-4-11(28-16-18(24)26-20-21(16)2)14(22)19-15-13(17(23)25-3)10-8-6-5-7-9-12(10)27-15/h11H,4-9H2,1-3H3,(H-,19,20,22,23,24) | CCC(C(=O)Nc1c(c2c(s1)CCCCC2)C(=O)OC)Sc3c(on[n+]3C)[O-] | |
| AKOS005251981 | 425.522 | C18 H23 N3 O5 S2 | UOIHSQAPBJRBPJ-UHFFFAOYSA-N | InChI=1S/C18H23N3O5S2/c1-5-11(28-16-18(24)26-20-21(16)3)14(22)19-15-13(17(23)25-4)10-7-6-9(2)8-12(10)27-15/h9,11H,5-8H2,1-4H3,(H-,19,20,22,23,24) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C)C(=O)OC)Sc3c(on[n+]3C)[O-] | |
| AKOS005252540 | 425.522 | C18 H23 N3 O5 S2 | ARUHOPQPGRZGFJ-UHFFFAOYSA-N | InChI=1S/C18H23N3O5S2/c1-4-25-17(23)14-11-6-5-10(2)9-12(11)28-15(14)19-13(22)7-8-27-16-18(24)26-20-21(16)3/h10H,4-9H2,1-3H3,(H-,19,20,22,23,24) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3C)[O-])CC(CC2)C | |
| AKOS005252643 | 425.522 | C18 H23 N3 O5 S2 | XFWRSBFIZYVHIT-UHFFFAOYSA-N | InChI=1S/C18H23N3O5S2/c1-3-25-17(23)14-11-7-5-4-6-8-12(11)28-15(14)19-13(22)9-10-27-16-18(24)26-20-21(16)2/h3-10H2,1-2H3,(H-,19,20,22,23,24) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3C)[O-])CCCCC2 | |
| AKOS005252644 | 425.522 | C18 H23 N3 O5 S2 | OACBEKRXIBRARQ-UHFFFAOYSA-N | InChI=1S/C18H23N3O5S2/c1-21-16(18(24)26-20-21)27-10-9-13(22)19-15-14(17(23)25-2)11-7-5-3-4-6-8-12(11)28-15/h3-10H2,1-2H3,(H-,19,20,22,23,24) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2c(c3c(s2)CCCCCC3)C(=O)OC | |
| AKOS005251375 | 373.406 | C18 H23 N5 O4 | WRMYIIPGZFZHAB-UHFFFAOYSA-O | InChI=1S/C18H22N5O4/c1-22(2)11-7-10-19-17(25)14(12-15-18(26)27-21-23(15)3)20-16(24)13-8-5-4-6-9-13/h4-6,8-9,12H,7,10-11H2,1-3H3,(H,19,25)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCCN(C)C)\NC(=O)c2ccccc2 | |
| AKOS005214266 | 330.425 | C18 H26 N4 O2 | QOIBHWPZGSHKBE-UHFFFAOYSA-N | InChI=1S/C18H26N4O2/c1-14(2)22-17(18(23)24-20-22)12-19-16-8-10-21(11-9-16)13-15-6-4-3-5-7-15/h3-7,14,16,19H,8-13H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNC2CCN(CC2)Cc3ccccc3 | |
| AKOS005253464 | 479.368 | C18 H9 F4 N7 O3 S | GRJUBAKDTPLFCO-UHFFFAOYSA-N | InChI=1S/C18H9F4N7O3S/c1-29-13(18(31)32-28-29)7-4(3-23)15(25)27-17-8(7)11(24)14(33-17)16(30)26-12-9(21)5(19)2-6(20)10(12)22/h2H,1H3,(H5-,24,25,26,27,28,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4c(c(cc(c4F)F)F)F)N)N)C#N | |
| AKOS005253600 | 479.368 | C18 H9 F4 N7 O3 S | YMPLTXKCJNBWRW-UHFFFAOYSA-N | InChI=1S/C18H9F4N7O3S/c1-29-15(18(31)32-28-29)11-6(3-23)16(25)27-17(7(11)4-24)33-5-10(30)26-14-12(21)8(19)2-9(20)13(14)22/h2H,5H2,1H3,(H3-,25,26,27,28,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3c(c(cc(c3F)F)F)F)N)C#N | |
| AKOS005253527 | 509.849 | C19 H11 Cl F3 N7 O3 S | CGSCTKFCEMTLBP-UHFFFAOYSA-N | InChI=1S/C19H11ClF3N7O3S/c1-30-13(18(32)33-29-30)10-7(5-24)15(26)28-17-11(10)12(25)14(34-17)16(31)27-9-3-2-6(20)4-8(9)19(21,22)23/h2-4H,1H3,(H5-,25,26,27,28,29,31,32) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(cc4C(F)(F)F)Cl)N)N)C#N | |
| AKOS005253528 | 509.849 | C19 H11 Cl F3 N7 O3 S | LBCBJIKXLWVBQS-UHFFFAOYSA-N | InChI=1S/C19H11ClF3N7O3S/c1-30-13(18(32)33-29-30)10-7(5-24)15(26)28-17-11(10)12(25)14(34-17)16(31)27-9-4-6(19(21,22)23)2-3-8(9)20/h2-4H,1H3,(H5-,25,26,27,28,29,31,32) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4cc(ccc4Cl)C(F)(F)F)N)N)C#N | |
| AKOS005253651 | 509.849 | C19 H11 Cl F3 N7 O3 S | QWINEDCFKKVSNJ-UHFFFAOYSA-N | InChI=1S/C19H11ClF3N7O3S/c1-30-15(18(32)33-29-30)14-9(5-24)16(26)28-17(10(14)6-25)34-7-13(31)27-12-3-2-8(20)4-11(12)19(21,22)23/h2-4H,7H2,1H3,(H3-,26,27,28,29,31,32) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(cc3C(F)(F)F)Cl)N)C#N | |
| AKOS005253652 | 509.849 | C19 H11 Cl F3 N7 O3 S | CADXELSHUXVZFR-UHFFFAOYSA-N | InChI=1S/C19H11ClF3N7O3S/c1-30-15(18(32)33-29-30)14-9(5-24)16(26)28-17(10(14)6-25)34-7-13(31)27-12-4-8(19(21,22)23)2-3-11(12)20/h2-4H,7H2,1H3,(H3-,26,27,28,29,31,32) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3cc(ccc3Cl)C(F)(F)F)N)C#N | |
| AKOS005253210 | 493.394 | C19 H11 F4 N7 O3 S | QHQLDVUAASWQFK-UHFFFAOYSA-N | InChI=1S/C19H11F4N7O3S/c1-6(17(31)27-14-12(22)9(20)3-10(21)13(14)23)34-18-8(5-25)11(7(4-24)16(26)28-18)15-19(32)33-29-30(15)2/h3,6H,1-2H3,(H3-,26,27,28,29,31,32) | CC(C(=O)Nc1c(c(cc(c1F)F)F)F)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005250678 | 429.9 | C19 H12 Cl N3 O3 S2 | FQOVBONKBVDPNB-UHFFFAOYSA-N | InChI=1S/C19H12ClN3O3S2/c20-13-8-6-12(7-9-13)15-10-27-19(21-15)28-11-16(24)17-18(25)26-22-23(17)14-4-2-1-3-5-14/h1-10H,11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nc(cs3)c4ccc(cc4)Cl | |
| AKOS005253442 | 485.86 | C19 H12 Cl N7 O5 S | APMOQESAGJGBLR-UHFFFAOYSA-N | InChI=1S/C19H12ClN7O5S/c1-27-13(19(31)32-26-27)10-8(5-21)15(23)25-17-11(10)12(22)14(33-17)16(28)24-6-2-3-9(20)7(4-6)18(29)30/h2-4H,1H3,(H6-,22,23,24,25,26,28,29,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(c(c4)C(=O)O)Cl)N)N)C#N | |
| AKOS005253443 | 485.86 | C19 H12 Cl N7 O5 S | FGQZZEAGJWPSHO-UHFFFAOYSA-N | InChI=1S/C19H12ClN7O5S/c1-27-13(19(31)32-26-27)10-7(5-21)15(23)25-17-11(10)12(22)14(33-17)16(28)24-9-4-6(18(29)30)2-3-8(9)20/h2-4H,1H3,(H6-,22,23,24,25,26,28,29,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4cc(ccc4Cl)C(=O)O)N)N)C#N | |
| AKOS005253572 | 485.86 | C19 H12 Cl N7 O5 S | IZBXPVPEYGRWFN-UHFFFAOYSA-N | InChI=1S/C19H12ClN7O5S/c1-27-15(19(31)32-26-27)14-10(5-21)16(23)25-17(11(14)6-22)33-7-13(28)24-8-2-3-12(20)9(4-8)18(29)30/h2-4H,7H2,1H3,(H4-,23,24,25,26,28,29,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(c(c3)C(=O)O)Cl)N)C#N | |
| AKOS005253575 | 485.86 | C19 H12 Cl N7 O5 S | QGUKNANTWXYVLI-UHFFFAOYSA-N | InChI=1S/C19H12ClN7O5S/c1-27-15(19(31)32-26-27)14-9(5-21)16(23)25-17(10(14)6-22)33-7-13(28)24-12-4-8(18(29)30)2-3-11(12)20/h2-4H,7H2,1H3,(H4-,23,24,25,26,28,29,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3cc(ccc3Cl)C(=O)O)N)C#N | |
| AKOS005253613 | 475.404 | C19 H12 F3 N7 O3 S | TWZQMRGYWCWVIT-UHFFFAOYSA-N | InChI=1S/C19H12F3N7O3S/c1-29-13(18(31)32-28-29)10-7(6-23)15(25)27-17-11(10)12(24)14(33-17)16(30)26-9-5-3-2-4-8(9)19(20,21)22/h2-5H,1H3,(H5-,24,25,26,27,28,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccccc4C(F)(F)F)N)N)C#N | |
| AKOS005253614 | 475.404 | C19 H12 F3 N7 O3 S | BPXHPPPHFMZMHI-UHFFFAOYSA-N | InChI=1S/C19H12F3N7O3S/c1-29-13(18(31)32-28-29)10-9(6-23)15(25)27-17-11(10)12(24)14(33-17)16(30)26-8-4-2-3-7(5-8)19(20,21)22/h2-5H,1H3,(H5-,24,25,26,27,28,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4cccc(c4)C(F)(F)F)N)N)C#N | |
| AKOS005253645 | 475.404 | C19 H12 F3 N7 O3 S | QSYJBKJNLUCJDW-UHFFFAOYSA-N | InChI=1S/C19H12F3N7O3S/c1-29-15(18(31)32-28-29)14-9(6-23)16(25)27-17(10(14)7-24)33-8-13(30)26-12-5-3-2-4-11(12)19(20,21)22/h2-5H,8H2,1H3,(H3-,25,26,27,28,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccccc3C(F)(F)F)N)C#N | |
| AKOS005253646 | 475.404 | C19 H12 F3 N7 O3 S | BDSQCYDPHGRLDU-UHFFFAOYSA-N | InChI=1S/C19H12F3N7O3S/c1-29-15(18(31)32-28-29)14-11(6-23)16(25)27-17(12(14)7-24)33-8-13(30)26-10-4-2-3-9(5-10)19(20,21)22/h2-5H,8H2,1H3,(H3-,25,26,27,28,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3cccc(c3)C(F)(F)F)N)C#N | |
| AKOS005253504 | 491.403 | C19 H12 F3 N7 O4 S | WDWCTJWWIOCLSA-UHFFFAOYSA-N | InChI=1S/C19H12F3N7O4S/c1-29-13(18(31)33-28-29)10-9(6-23)15(25)27-17-11(10)12(24)14(34-17)16(30)26-7-2-4-8(5-3-7)32-19(20,21)22/h2-5H,1H3,(H5-,24,25,26,27,28,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(cc4)OC(F)(F)F)N)N)C#N | |
| AKOS005253511 | 491.403 | C19 H12 F3 N7 O4 S | UGNWQNYOTZWNDA-UHFFFAOYSA-N | InChI=1S/C19H12F3N7O4S/c1-29-13(18(31)33-28-29)10-7(6-23)15(25)27-17-11(10)12(24)14(34-17)16(30)26-8-4-2-3-5-9(8)32-19(20,21)22/h2-5H,1H3,(H5-,24,25,26,27,28,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccccc4OC(F)(F)F)N)N)C#N | |
| AKOS005253577 | 491.403 | C19 H12 F3 N7 O4 S | VMBUMZBHQRLLTO-UHFFFAOYSA-N | InChI=1S/C19H12F3N7O4S/c1-29-15(18(31)33-28-29)14-9(6-23)16(25)27-17(10(14)7-24)34-8-13(30)26-11-4-2-3-5-12(11)32-19(20,21)22/h2-5H,8H2,1H3,(H3-,25,26,27,28,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccccc3OC(F)(F)F)N)C#N | |
| AKOS005253637 | 491.403 | C19 H12 F3 N7 O4 S | WLHCWYFRXWZSJH-UHFFFAOYSA-N | InChI=1S/C19H12F3N7O4S/c1-29-15(18(31)33-28-29)14-11(6-23)16(25)27-17(12(14)7-24)34-8-13(30)26-9-2-4-10(5-3-9)32-19(20,21)22/h2-5H,8H2,1H3,(H3-,25,26,27,28,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(cc3)OC(F)(F)F)N)C#N | |
| AKOS005252006 | 495.371 | C19 H12 F7 N3 O3 S | RXYFSECKWNOHGT-UHFFFAOYSA-N | InChI=1S/C19H12F7N3O3S/c1-2-9(33-17-18(31)32-28-29(17)8-6-4-3-5-7-8)16(30)27-15-13(22)11(20)10(19(24,25)26)12(21)14(15)23/h3-7,9H,2H2,1H3,(H-,27,28,30,31) | CCC(C(=O)Nc1c(c(c(c(c1F)F)C(F)(F)F)F)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251847 | 511.37 | C19 H12 F7 N3 O4 S | JMQRHBHHAGASGC-UHFFFAOYSA-N | InChI=1S/C19H12F7N3O4S/c1-7(34-17-18(31)33-28-29(17)8-3-5-9(32-2)6-4-8)16(30)27-15-13(22)11(20)10(19(24,25)26)12(21)14(15)23/h3-7H,1-2H3,(H-,27,28,30,31) | CC(C(=O)Nc1c(c(c(c(c1F)F)C(F)(F)F)F)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252174 | 511.37 | C19 H12 F7 N3 O4 S | HOXJLJSYJYJOKJ-UHFFFAOYSA-N | InChI=1S/C19H12F7N3O4S/c1-32-9-4-2-8(3-5-9)29-17(18(31)33-28-29)34-7-6-10(30)27-16-14(22)12(20)11(19(24,25)26)13(21)15(16)23/h2-5H,6-7H2,1H3,(H-,27,28,30,31) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3c(c(c(c(c3F)F)C(F)(F)F)F)F | |
| AKOS005250811 | 404.402 | C19 H12 N6 O3 S | JHPYCGANCQBEGC-UHFFFAOYSA-N | InChI=1S/C19H12N6O3S/c26-14(16-18(27)28-24-25(16)11-6-2-1-3-7-11)10-29-19-21-17-15(22-23-19)12-8-4-5-9-13(12)20-17/h1-9H,10H2,(H-,20,21,22,23,24,26,27) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nc4c(c5ccccc5[nH]4)nn3 | |
| AKOS005253197 | 518.319 | C19 H13 Br F N7 O3 S | OHEKDUFHRSZFQE-UHFFFAOYSA-N | InChI=1S/C19H13BrFN7O3S/c1-8(17(29)25-13-4-3-9(20)5-12(13)21)32-18-11(7-23)14(10(6-22)16(24)26-18)15-19(30)31-27-28(15)2/h3-5,8H,1-2H3,(H3-,24,25,26,27,29,30) | CC(C(=O)Nc1ccc(cc1F)Br)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253213 | 473.868 | C19 H13 Cl F N7 O3 S | YQENFYLRNHMZOY-UHFFFAOYSA-N | InChI=1S/C19H13ClFN7O3S/c1-8(17(29)25-9-3-4-13(21)12(20)5-9)32-18-11(7-23)14(10(6-22)16(24)26-18)15-19(30)31-27-28(15)2/h3-5,8H,1-2H3,(H3-,24,25,26,27,29,30) | CC(C(=O)Nc1ccc(c(c1)Cl)F)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253229 | 490.323 | C19 H13 Cl2 N7 O3 S | JSIZRPBGOSNFPA-UHFFFAOYSA-N | InChI=1S/C19H13Cl2N7O3S/c1-8(17(29)25-12-5-3-4-11(20)14(12)21)32-18-10(7-23)13(9(6-22)16(24)26-18)15-19(30)31-27-28(15)2/h3-5,8H,1-2H3,(H3-,24,25,26,27,29,30) | CC(C(=O)Nc1cccc(c1Cl)Cl)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253236 | 490.323 | C19 H13 Cl2 N7 O3 S | UGTQAGLVVXEYLN-UHFFFAOYSA-N | InChI=1S/C19H13Cl2N7O3S/c1-8(17(29)25-13-4-3-9(20)5-12(13)21)32-18-11(7-23)14(10(6-22)16(24)26-18)15-19(30)31-27-28(15)2/h3-5,8H,1-2H3,(H3-,24,25,26,27,29,30) | CC(C(=O)Nc1ccc(cc1Cl)Cl)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253237 | 490.323 | C19 H13 Cl2 N7 O3 S | CDWMKUNJGGOKJG-UHFFFAOYSA-N | InChI=1S/C19H13Cl2N7O3S/c1-8(17(29)25-13-5-9(20)3-4-12(13)21)32-18-11(7-23)14(10(6-22)16(24)26-18)15-19(30)31-27-28(15)2/h3-5,8H,1-2H3,(H3-,24,25,26,27,29,30) | CC(C(=O)Nc1cc(ccc1Cl)Cl)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253244 | 490.323 | C19 H13 Cl2 N7 O3 S | HIKWOBDFPLHTPL-UHFFFAOYSA-N | InChI=1S/C19H13Cl2N7O3S/c1-8(17(29)25-9-3-4-12(20)13(21)5-9)32-18-11(7-23)14(10(6-22)16(24)26-18)15-19(30)31-27-28(15)2/h3-5,8H,1-2H3,(H3-,24,25,26,27,29,30) | CC(C(=O)Nc1ccc(c(c1)Cl)Cl)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253245 | 490.323 | C19 H13 Cl2 N7 O3 S | GEGQKHTXPXCJBV-UHFFFAOYSA-N | InChI=1S/C19H13Cl2N7O3S/c1-8(17(29)25-11-4-9(20)3-10(21)5-11)32-18-13(7-23)14(12(6-22)16(24)26-18)15-19(30)31-27-28(15)2/h3-5,8H,1-2H3,(H3-,24,25,26,27,29,30) | CC(C(=O)Nc1cc(cc(c1)Cl)Cl)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253243 | 457.413 | C19 H13 F2 N7 O3 S | OVXWYVCQAXYFBT-UHFFFAOYSA-N | InChI=1S/C19H13F2N7O3S/c1-8(17(29)25-9-3-4-12(20)13(21)5-9)32-18-11(7-23)14(10(6-22)16(24)26-18)15-19(30)31-27-28(15)2/h3-5,8H,1-2H3,(H3-,24,25,26,27,29,30) | CC(C(=O)Nc1ccc(c(c1)F)F)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005250444 | 450.391 | C19 H13 F3 N4 O4 S | XPTVWNOHOYWLDN-UHFFFAOYSA-N | InChI=1S/C19H13F3N4O4S/c1-10-7-14(19(20,21)22)13(8-23)17(24-10)31-9-15(27)16-18(28)30-25-26(16)11-3-5-12(29-2)6-4-11/h3-7H,9H2,1-2H3 | Cc1cc(c(c(n1)SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C#N)C(F)(F)F | |
| AKOS005250450 | 450.391 | C19 H13 F3 N4 O4 S | CBEPMASCXFUTCJ-UHFFFAOYSA-N | InChI=1S/C19H13F3N4O4S/c1-10-7-15(19(20,21)22)24-17(13(10)8-23)31-9-14(27)16-18(28)30-25-26(16)11-3-5-12(29-2)6-4-11/h3-7H,9H2,1-2H3 | Cc1cc(nc(c1C#N)SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C(F)(F)F | |
| AKOS005250691 | 450.391 | C19 H13 F3 N4 O4 S | INRKYKYPDBVNDG-UHFFFAOYSA-N | InChI=1S/C19H13F3N4O4S/c1-26-16(18(28)30-25-26)15(27)9-31-17-12(8-23)13(19(20,21)22)7-14(24-17)10-3-5-11(29-2)6-4-10/h3-7H,9H2,1-2H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2c(c(cc(n2)c3ccc(cc3)OC)C(F)(F)F)C#N | |
| AKOS005253721 | 450.391 | C19 H13 F3 N4 O4 S | GVHLXBDQHBMQCS-UHFFFAOYSA-N | InChI=1S/C19H13F3N4O4S/c1-8-7-11(19(20,21)22)24-17-12(8)13(23)16(31-17)15(27)14-18(28)30-25-26(14)9-3-5-10(29-2)6-4-9/h3-7H,1-2H3,(H2-,23,25,27,28) | Cc1cc(nc2c1c(c(s2)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N)C(F)(F)F | |
| AKOS005253881 | 450.391 | C19 H13 F3 N4 O4 S | XNVVWLDAIDYVKR-UHFFFAOYSA-N | InChI=1S/C19H13F3N4O4S/c1-26-14(18(28)30-25-26)15(27)16-13(23)12-10(19(20,21)22)7-11(24-17(12)31-16)8-3-5-9(29-2)6-4-8/h3-7H,1-2H3,(H2-,23,25,27,28) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4ccc(cc4)OC)C(F)(F)F)N | |
| AKOS005250676 | 395.455 | C19 H13 N3 O3 S2 | VQVWHOPATSRVRJ-UHFFFAOYSA-N | InChI=1S/C19H13N3O3S2/c23-16(17-18(24)25-21-22(17)14-9-5-2-6-10-14)12-27-19-20-15(11-26-19)13-7-3-1-4-8-13/h1-11H,12H2 | c1ccc(cc1)c2csc(n2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250110 | 363.324 | C19 H13 N3 O5 | GBMZKTXQHTXHEN-UHFFFAOYSA-N | InChI=1S/C19H13N3O5/c1-25-14-9-7-13(8-10-14)22-16(19(24)27-21-22)11-15-18(23)26-17(20-15)12-5-3-2-4-6-12/h2-11H,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C\3/C(=O)OC(=N3)c4ccccc4 | |
| AKOS005253444 | 451.415 | C19 H13 N7 O5 S | NMIBXBPMUZFIIK-UHFFFAOYSA-N | InChI=1S/C19H13N7O5S/c1-26-13(19(30)31-25-26)10-9(6-20)15(22)24-17-11(10)12(21)14(32-17)16(27)23-8-4-2-7(3-5-8)18(28)29/h2-5H,1H3,(H6-,21,22,23,24,25,27,28,29,30) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(cc4)C(=O)O)N)N)C#N | |
| AKOS005253447 | 451.415 | C19 H13 N7 O5 S | SHLUXFYWZHWPRE-UHFFFAOYSA-N | InChI=1S/C19H13N7O5S/c1-26-13(19(30)31-25-26)10-9(6-20)15(22)24-17-11(10)12(21)14(32-17)16(27)23-8-4-2-3-7(5-8)18(28)29/h2-5H,1H3,(H6-,21,22,23,24,25,27,28,29,30) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4cccc(c4)C(=O)O)N)N)C#N | |
| AKOS005253503 | 451.415 | C19 H13 N7 O5 S | GGINVFZIBQRUQN-UHFFFAOYSA-N | InChI=1S/C19H13N7O5S/c1-26-14(19(28)31-25-26)11-8(5-20)16(22)24-18-12(11)13(21)15(32-18)17(27)23-7-2-3-9-10(4-7)30-6-29-9/h2-4H,6H2,1H3,(H5-,21,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc5c(c4)OCO5)N)N)C#N | |
| AKOS005253576 | 451.415 | C19 H13 N7 O5 S | PTDKVPRCQNYILD-UHFFFAOYSA-N | InChI=1S/C19H13N7O5S/c1-26-15(19(30)31-25-26)14-11(6-20)16(22)24-17(12(14)7-21)32-8-13(27)23-10-4-2-9(3-5-10)18(28)29/h2-5H,8H2,1H3,(H4-,22,23,24,25,27,28,29,30) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(cc3)C(=O)O)N)C#N | |
| AKOS005253583 | 451.415 | C19 H13 N7 O5 S | LGPCPGYROILVOS-UHFFFAOYSA-N | InChI=1S/C19H13N7O5S/c1-26-15(19(30)31-25-26)14-11(6-20)16(22)24-17(12(14)7-21)32-8-13(27)23-10-4-2-3-9(5-10)18(28)29/h2-5H,8H2,1H3,(H4-,22,23,24,25,27,28,29,30) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3cccc(c3)C(=O)O)N)C#N | |
| AKOS005253636 | 451.415 | C19 H13 N7 O5 S | QZZSKNPHQIMLQL-UHFFFAOYSA-N | InChI=1S/C19H13N7O5S/c1-26-16(19(28)31-25-26)15-10(5-20)17(22)24-18(11(15)6-21)32-7-14(27)23-9-2-3-12-13(4-9)30-8-29-12/h2-4H,7-8H2,1H3,(H3-,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc4c(c3)OCO4)N)C#N | |
| AKOS005253487 | 467.415 | C19 H13 N7 O6 S | UFPNDZSYXOKBNJ-UHFFFAOYSA-N | InChI=1S/C19H13N7O6S/c1-26-13(19(31)32-25-26)10-8(5-20)15(22)24-17-11(10)12(21)14(33-17)16(28)23-6-2-3-9(27)7(4-6)18(29)30/h2-4,25H,1H3,(H6,21,22,24,28,29,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(c(c4)C(=O)O)O)N)N)C#N | |
| AKOS005253623 | 467.415 | C19 H13 N7 O6 S | PJPLRHDLHXCJDB-UHFFFAOYSA-N | InChI=1S/C19H13N7O6S/c1-26-15(19(31)32-25-26)14-10(5-20)16(22)24-17(11(14)6-21)33-7-13(28)23-8-2-3-12(27)9(4-8)18(29)30/h2-4,25H,7H2,1H3,(H4,22,24,29,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(c(c3)C(=O)O)O)N)C#N | |
| AKOS005253190 | 500.329 | C19 H14 Br N7 O3 S | OOWLQIVYUNVVLF-UHFFFAOYSA-N | InChI=1S/C19H14BrN7O3S/c1-9(17(28)24-13-6-4-3-5-12(13)20)31-18-11(8-22)14(10(7-21)16(23)25-18)15-19(29)30-26-27(15)2/h3-6,9H,1-2H3,(H3-,23,24,25,26,28,29) | CC(C(=O)Nc1ccccc1Br)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253196 | 500.329 | C19 H14 Br N7 O3 S | AGHITGITXKGRER-UHFFFAOYSA-N | InChI=1S/C19H14BrN7O3S/c1-9(17(28)24-11-5-3-10(20)4-6-11)31-18-13(8-22)14(12(7-21)16(23)25-18)15-19(29)30-26-27(15)2/h3-6,9H,1-2H3,(H3-,23,24,25,26,28,29) | CC(C(=O)Nc1ccc(cc1)Br)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253204 | 455.878 | C19 H14 Cl N7 O3 S | XVFPXJFSBFIMQG-UHFFFAOYSA-N | InChI=1S/C19H14ClN7O3S/c1-9(17(28)24-13-6-4-3-5-12(13)20)31-18-11(8-22)14(10(7-21)16(23)25-18)15-19(29)30-26-27(15)2/h3-6,9H,1-2H3,(H3-,23,24,25,26,28,29) | CC(C(=O)Nc1ccccc1Cl)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253205 | 455.878 | C19 H14 Cl N7 O3 S | SLEQFBPSWAIFIR-UHFFFAOYSA-N | InChI=1S/C19H14ClN7O3S/c1-9(17(28)24-11-5-3-4-10(20)6-11)31-18-13(8-22)14(12(7-21)16(23)25-18)15-19(29)30-26-27(15)2/h3-6,9H,1-2H3,(H3-,23,24,25,26,28,29) | CC(C(=O)Nc1cccc(c1)Cl)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253212 | 455.878 | C19 H14 Cl N7 O3 S | LLZIRXNTHRLSRU-UHFFFAOYSA-N | InChI=1S/C19H14ClN7O3S/c1-9(17(28)24-11-5-3-10(20)4-6-11)31-18-13(8-22)14(12(7-21)16(23)25-18)15-19(29)30-26-27(15)2/h3-6,9H,1-2H3,(H3-,23,24,25,26,28,29) | CC(C(=O)Nc1ccc(cc1)Cl)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253523 | 455.878 | C19 H14 Cl N7 O3 S | CFDHQYDKQOJIHC-UHFFFAOYSA-N | InChI=1S/C19H14ClN7O3S/c1-7-3-4-8(5-10(7)20)24-17(28)15-13(22)12-11(14-19(29)30-26-27(14)2)9(6-21)16(23)25-18(12)31-15/h3-5H,1-2H3,(H5-,22,23,24,25,26,28,29) | Cc1ccc(cc1Cl)NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N | |
| AKOS005253524 | 455.878 | C19 H14 Cl N7 O3 S | BHAIHCQDXKRUDV-UHFFFAOYSA-N | InChI=1S/C19H14ClN7O3S/c1-7-3-4-8(20)5-10(7)24-17(28)15-13(22)12-11(14-19(29)30-26-27(14)2)9(6-21)16(23)25-18(12)31-15/h3-5H,1-2H3,(H5-,22,23,24,25,26,28,29) | Cc1ccc(cc1NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N)Cl | |
| AKOS005253546 | 455.878 | C19 H14 Cl N7 O3 S | BXSFQYOZXGAGAO-UHFFFAOYSA-N | InChI=1S/C19H14ClN7O3S/c1-9-12(20)4-3-5-13(9)24-14(28)8-31-18-11(7-22)15(10(6-21)17(23)25-18)16-19(29)30-26-27(16)2/h3-5H,8H2,1-2H3,(H3-,23,24,25,26,28,29) | Cc1c(cccc1Cl)NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253590 | 455.878 | C19 H14 Cl N7 O3 S | BVSWQPSRXITBMJ-UHFFFAOYSA-N | InChI=1S/C19H14ClN7O3S/c1-7-9(20)4-3-5-10(7)24-17(28)15-13(22)12-11(14-19(29)30-26-27(14)2)8(6-21)16(23)25-18(12)31-15/h3-5H,1-2H3,(H5-,22,23,24,25,26,28,29) | Cc1c(cccc1Cl)NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N | |
| AKOS005253647 | 455.878 | C19 H14 Cl N7 O3 S | JKZZYDNLEQICLM-UHFFFAOYSA-N | InChI=1S/C19H14ClN7O3S/c1-9-3-4-10(5-13(9)20)24-14(28)8-31-18-12(7-22)15(11(6-21)17(23)25-18)16-19(29)30-26-27(16)2/h3-5H,8H2,1-2H3,(H3-,23,24,25,26,28,29) | Cc1ccc(cc1Cl)NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253648 | 455.878 | C19 H14 Cl N7 O3 S | SPGBHWOVYNLRCM-UHFFFAOYSA-N | InChI=1S/C19H14ClN7O3S/c1-9-3-4-10(20)5-13(9)24-14(28)8-31-18-12(7-22)15(11(6-21)17(23)25-18)16-19(29)30-26-27(16)2/h3-5H,8H2,1-2H3,(H3-,23,24,25,26,28,29) | Cc1ccc(cc1NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N)Cl | |
| AKOS005253448 | 471.877 | C19 H14 Cl N7 O4 S | GHTPUHZWOJNLON-UHFFFAOYSA-N | InChI=1S/C19H14ClN7O4S/c1-27-14(19(29)31-26-27)11-8(6-21)16(23)25-18-12(11)13(22)15(32-18)17(28)24-7-3-4-10(30-2)9(20)5-7/h3-5H,1-2H3,(H5-,22,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(c(c4)Cl)OC)N)N)C#N | |
| AKOS005253455 | 471.877 | C19 H14 Cl N7 O4 S | YXUPERUFFANXKM-UHFFFAOYSA-N | InChI=1S/C19H14ClN7O4S/c1-27-14(19(29)31-26-27)11-8(6-21)16(23)25-18-12(11)13(22)15(32-18)17(28)24-9-5-7(20)3-4-10(9)30-2/h3-5H,1-2H3,(H5-,22,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4cc(ccc4OC)Cl)N)N)C#N | |
| AKOS005253584 | 471.877 | C19 H14 Cl N7 O4 S | BKHZTSNHXDZBRA-UHFFFAOYSA-N | InChI=1S/C19H14ClN7O4S/c1-27-16(19(29)31-26-27)15-10(6-21)17(23)25-18(11(15)7-22)32-8-14(28)24-9-3-4-13(30-2)12(20)5-9/h3-5H,8H2,1-2H3,(H3-,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(c(c3)Cl)OC)N)C#N | |
| AKOS005253591 | 471.877 | C19 H14 Cl N7 O4 S | FBDLCXGCCYNDJQ-UHFFFAOYSA-N | InChI=1S/C19H14ClN7O4S/c1-27-16(19(29)31-26-27)15-10(6-21)17(23)25-18(11(15)7-22)32-8-14(28)24-12-5-9(20)3-4-13(12)30-2/h3-5H,8H2,1-2H3,(H3-,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3cc(ccc3OC)Cl)N)C#N | |
| AKOS005253200 | 439.423 | C19 H14 F N7 O3 S | RYBSEQFTKKCHCB-UHFFFAOYSA-N | InChI=1S/C19H14FN7O3S/c1-9(17(28)24-13-6-4-3-5-12(13)20)31-18-11(8-22)14(10(7-21)16(23)25-18)15-19(29)30-26-27(15)2/h3-6,9H,1-2H3,(H3-,23,24,25,26,28,29) | CC(C(=O)Nc1ccccc1F)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253201 | 439.423 | C19 H14 F N7 O3 S | DOBUGEIBQMKEJT-UHFFFAOYSA-N | InChI=1S/C19H14FN7O3S/c1-9(17(28)24-11-5-3-10(20)4-6-11)31-18-13(8-22)14(12(7-21)16(23)25-18)15-19(29)30-26-27(15)2/h3-6,9H,1-2H3,(H3-,23,24,25,26,28,29) | CC(C(=O)Nc1ccc(cc1)F)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005252483 | 433.407 | C19 H14 F3 N5 O2 S | GPWVMVUHLGFPQJ-UHFFFAOYSA-N | InChI=1S/C19H14F3N5O2S/c1-2-27-10-17(29-26-27)25-16(28)11-30-18-13(9-23)14(19(20,21)22)8-15(24-18)12-6-4-3-5-7-12/h3-8,10H,2,11H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)C(F)(F)F)C#N | |
| AKOS005252413 | 449.406 | C19 H14 F3 N5 O3 S | AMTUHPNNLNMYLT-UHFFFAOYSA-N | InChI=1S/C19H14F3N5O3S/c1-27-9-17(30-26-27)25-16(28)10-31-18-13(8-23)14(19(20,21)22)7-15(24-18)11-3-5-12(29-2)6-4-11/h3-7,9H,10H2,1-2H3 | C[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccc(cc3)OC)C(F)(F)F)C#N | |
| AKOS005253208 | 547.329 | C19 H14 I N7 O3 S | VPFVJHYMNDXMMD-UHFFFAOYSA-N | InChI=1S/C19H14IN7O3S/c1-9(17(28)24-11-5-3-10(20)4-6-11)31-18-13(8-22)14(12(7-21)16(23)25-18)15-19(29)30-26-27(15)2/h3-6,9H,1-2H3,(H3-,23,24,25,26,28,29) | CC(C(=O)Nc1ccc(cc1)I)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005219523 | 378.404 | C19 H14 N4 O3 S | QNHIKDRGXIGYEU-UHFFFAOYSA-N | InChI=1S/C19H14N4O3S/c20-10-13-9-12-5-4-8-15(12)21-18(13)27-11-16(24)17-19(25)26-22-23(17)14-6-2-1-3-7-14/h1-3,6-7,9H,4-5,8,11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(cc4c(n3)CCC4)C#N | |
| AKOS005251148 | 378.404 | C19 H14 N4 O3 S | YSEWMORIDCOGHT-UHFFFAOYSA-N | InChI=1S/C19H14N4O3S/c24-17(21-16-10-4-9-15-14(16)8-5-11-20-15)12-27-18-19(25)26-22-23(18)13-6-2-1-3-7-13/h1-11H,12H2,(H-,20,21,22,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cccc4c3cccn4 | |
| AKOS005253683 | 378.404 | C19 H14 N4 O3 S | WIJFEGWKEJKKPT-UHFFFAOYSA-N | InChI=1S/C19H14N4O3S/c20-14-12-9-10-5-4-8-13(10)21-18(12)27-17(14)16(24)15-19(25)26-22-23(15)11-6-2-1-3-7-11/h1-3,6-7,9H,4-5,8H2,(H2-,20,22,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4cc5c(nc4s3)CCC5)N | |
| AKOS005250163 | 362.339 | C19 H14 N4 O4 | ZHFOUIPWSWEOSS-UHFFFAOYSA-N | InChI=1S/C19H14N4O4/c1-26-13-9-7-12(8-10-13)23-17(19(25)27-22-23)18(24)21-16-6-2-5-15-14(16)4-3-11-20-15/h2-11H,1H3,(H-,20,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3cccc4c3cccn4 | |
| AKOS005219865 | 394.404 | C19 H14 N4 O4 S | LCAZBTHQZZSOIZ-UHFFFAOYSA-O | InChI=1S/C19H13N4O4S/c1-26-14-9-7-13(8-10-14)23-16(18(25)27-21-23)11-15-17(24)22(19(28)20-15)12-5-3-2-4-6-12/h2-11H,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C\3/C(=O)N(C(=N3)S)c4ccccc4 | |
| AKOS005250702 | 394.404 | C19 H14 N4 O4 S | YAKQVNZZVUADHR-UHFFFAOYSA-N | InChI=1S/C19H14N4O4S/c1-22-16(18(26)27-21-22)15(24)11-28-19-20-14-10-6-5-9-13(14)17(25)23(19)12-7-3-2-4-8-12/h2-10H,11H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2nc3ccccc3c(=O)n2c4ccccc4 | |
| AKOS005250803 | 394.404 | C19 H14 N4 O4 S | XFBNTJDWSMARLG-UHFFFAOYSA-N | InChI=1S/C19H14N4O4S/c1-22-17(25)13-9-5-6-10-14(13)20-19(22)28-11-15(24)16-18(26)27-21-23(16)12-7-3-2-4-8-12/h2-10H,11H2,1H3 | Cn1c(=O)c2ccccc2nc1SCC(=O)c3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250738 | 426.469 | C19 H14 N4 O4 S2 | FLBPIEBTTAENRJ-GXDHUFHOSA-N | InChI=1S/C19H14N4O4S2/c1-22-16(18(26)27-21-22)15(24)11-29-19-20-14(10-13-8-5-9-28-13)17(25)23(19)12-6-3-2-4-7-12/h2-10H,11H2,1H3/b14-10+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3cccs3)/C(=O)N2c4ccccc4 | |
| AKOS005250693 | 410.403 | C19 H14 N4 O5 S | NXQTUENNGRUZJZ-GXDHUFHOSA-N | InChI=1S/C19H14N4O5S/c1-22-16(18(26)28-21-22)15(24)11-29-19-20-14(10-13-8-5-9-27-13)17(25)23(19)12-6-3-2-4-7-12/h2-10H,11H2,1H3/b14-10+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3ccco3)/C(=O)N2c4ccccc4 | |
| AKOS005252472 | 390.418 | C19 H14 N6 O2 S | MCJGYGKKYXVBJO-UHFFFAOYSA-N | InChI=1S/C19H14N6O2S/c1-2-25-9-15(27-24-25)20-14(26)10-28-19-21-17-12-7-3-5-11-6-4-8-13(16(11)12)18(17)22-23-19/h3-9H,2,10H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2nc-3c(nn2)-c4cccc5c4c3ccc5 | |
| AKOS005250728 | 406.418 | C19 H14 N6 O3 S | NSOJBSGJATVKFS-UHFFFAOYSA-N | InChI=1S/C19H14N6O3S/c1-10-3-5-11(6-4-10)15-12(7-20)17(22)23-18(13(15)8-21)29-9-14(26)16-19(27)28-24-25(16)2/h3-6H,9H2,1-2H3,(H2-,22,23,24,26,27) | Cc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)c3c(on[n+]3C)[O-])N)C#N | |
| AKOS005253784 | 406.418 | C19 H14 N6 O3 S | BSQIPLXAJZPLLF-UHFFFAOYSA-N | InChI=1S/C19H14N6O3S/c1-8-3-5-9(6-4-8)11-10(7-20)17(22)23-18-12(11)13(21)16(29-18)15(26)14-19(27)28-24-25(14)2/h3-6H,1-2H3,(H4-,21,22,23,24,26,27) | Cc1ccc(cc1)c2c(c(nc3c2c(c(s3)C(=O)c4c(on[n+]4C)[O-])N)N)C#N | |
| AKOS005253472 | 450.431 | C19 H14 N8 O4 S | CADYGMJHDPQEMN-UHFFFAOYSA-N | InChI=1S/C19H14N8O4S/c1-27-13(19(30)31-26-27)10-9(6-20)15(22)25-18-11(10)12(21)14(32-18)17(29)24-8-4-2-7(3-5-8)16(23)28/h2-5H,1H3,(H7-,21,22,23,24,25,26,28,29,30) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(cc4)C(=O)N)N)N)C#N | |
| AKOS005253479 | 450.431 | C19 H14 N8 O4 S | RIKCCTVYAXACNW-UHFFFAOYSA-N | InChI=1S/C19H14N8O4S/c1-27-13(19(30)31-26-27)10-8(6-20)15(22)25-18-11(10)12(21)14(32-18)17(29)24-9-5-3-2-4-7(9)16(23)28/h2-5H,1H3,(H7-,21,22,23,24,25,26,28,29,30) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccccc4C(=O)N)N)N)C#N | |
| AKOS005253608 | 450.431 | C19 H14 N8 O4 S | SXRFIXUXMZLKPI-UHFFFAOYSA-N | InChI=1S/C19H14N8O4S/c1-27-15(19(30)31-26-27)14-11(6-20)16(22)25-18(12(14)7-21)32-8-13(28)24-10-4-2-9(3-5-10)17(23)29/h2-5H,8H2,1H3,(H5-,22,23,24,25,26,28,29,30) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(cc3)C(=O)N)N)C#N | |
| AKOS005253615 | 450.431 | C19 H14 N8 O4 S | NCCZJWRPUOPJNT-UHFFFAOYSA-N | InChI=1S/C19H14N8O4S/c1-27-15(19(30)31-26-27)14-10(6-20)16(22)25-18(11(14)7-21)32-8-13(28)24-12-5-3-2-4-9(12)17(23)29/h2-5H,8H2,1H3,(H5-,22,23,24,25,26,28,29,30) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccccc3C(=O)N)N)C#N | |
| AKOS005253192 | 466.43 | C19 H14 N8 O5 S | YVYXACFCEHMICK-UHFFFAOYSA-N | InChI=1S/C19H14N8O5S/c1-9(17(28)23-10-3-5-11(6-4-10)27(30)31)33-18-13(8-21)14(12(7-20)16(22)24-18)15-19(29)32-25-26(15)2/h3-6,9H,1-2H3,(H3-,22,23,24,25,28,29) | CC(C(=O)Nc1ccc(cc1)N(=O)=O)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253436 | 466.43 | C19 H14 N8 O5 S | ZUDCBAFDAUWTFM-UHFFFAOYSA-N | InChI=1S/C19H14N8O5S/c1-7-5-8(27(30)31)3-4-10(7)23-17(28)15-13(21)12-11(14-19(29)32-25-26(14)2)9(6-20)16(22)24-18(12)33-15/h3-5H,1-2H3,(H5-,21,22,23,24,25,28,29) | Cc1cc(ccc1NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N)N(=O)=O | |
| AKOS005253437 | 466.43 | C19 H14 N8 O5 S | RUUZDJIFNMDSCL-UHFFFAOYSA-N | InChI=1S/C19H14N8O5S/c1-7-3-4-8(27(30)31)5-10(7)23-17(28)15-13(21)12-11(14-19(29)32-25-26(14)2)9(6-20)16(22)24-18(12)33-15/h3-5H,1-2H3,(H5-,21,22,23,24,25,28,29) | Cc1ccc(cc1NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N)N(=O)=O | |
| AKOS005253566 | 466.43 | C19 H14 N8 O5 S | JVMCSUNCDIOMKN-UHFFFAOYSA-N | InChI=1S/C19H14N8O5S/c1-9-5-10(27(30)31)3-4-13(9)23-14(28)8-33-18-12(7-21)15(11(6-20)17(22)24-18)16-19(29)32-25-26(16)2/h3-5H,8H2,1-2H3,(H3-,22,23,24,25,28,29) | Cc1cc(ccc1NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N)N(=O)=O | |
| AKOS005253567 | 466.43 | C19 H14 N8 O5 S | HKKHEWQFKRFNSY-UHFFFAOYSA-N | InChI=1S/C19H14N8O5S/c1-9-3-4-10(27(30)31)5-13(9)23-14(28)8-33-18-12(7-21)15(11(6-20)17(22)24-18)16-19(29)32-25-26(16)2/h3-5H,8H2,1-2H3,(H3-,22,23,24,25,28,29) | Cc1ccc(cc1NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N)N(=O)=O | |
| AKOS005253285 | 443.251 | C19 H15 Br N4 O4 | CYFNTUWIWYSLFX-UHFFFAOYSA-N | InChI=1S/C19H15BrN4O4/c20-12-6-8-13(9-7-12)23-17(25)10-15(18(23)26)21-11-16-19(27)28-22-24(16)14-4-2-1-3-5-14/h1-9,15,21H,10-11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)Br | |
| AKOS005252034 | 457.854 | C19 H15 Cl F3 N3 O3 S | YWUCKGFXIQPAOT-UHFFFAOYSA-N | InChI=1S/C19H15ClF3N3O3S/c1-2-15(16(27)24-14-9-8-11(20)10-13(14)19(21,22)23)30-17-18(28)29-25-26(17)12-6-4-3-5-7-12/h3-10,15H,2H2,1H3,(H-,24,25,27,28) | CCC(C(=O)Nc1ccc(cc1C(F)(F)F)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252037 | 457.854 | C19 H15 Cl F3 N3 O3 S | NRINOBVWRAXNLU-UHFFFAOYSA-N | InChI=1S/C19H15ClF3N3O3S/c1-2-15(16(27)24-14-10-11(19(21,22)23)8-9-13(14)20)30-17-18(28)29-25-26(17)12-6-4-3-5-7-12/h3-10,15H,2H2,1H3,(H-,24,25,27,28) | CCC(C(=O)Nc1cc(ccc1Cl)C(F)(F)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251843 | 473.853 | C19 H15 Cl F3 N3 O4 S | SBVIINHJIHFWMQ-UHFFFAOYSA-N | InChI=1S/C19H15ClF3N3O4S/c1-10(16(27)24-15-8-3-11(20)9-14(15)19(21,22)23)31-17-18(28)30-25-26(17)12-4-6-13(29-2)7-5-12/h3-10H,1-2H3,(H-,24,25,27,28) | CC(C(=O)Nc1ccc(cc1C(F)(F)F)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251850 | 473.853 | C19 H15 Cl F3 N3 O4 S | PRUBNCMYQFOCBX-UHFFFAOYSA-N | InChI=1S/C19H15ClF3N3O4S/c1-10(16(27)24-15-9-11(19(21,22)23)3-8-14(15)20)31-17-18(28)30-25-26(17)12-4-6-13(29-2)7-5-12/h3-10H,1-2H3,(H-,24,25,27,28) | CC(C(=O)Nc1cc(ccc1Cl)C(F)(F)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252210 | 473.853 | C19 H15 Cl F3 N3 O4 S | NXVQZPLYCWTQIV-UHFFFAOYSA-N | InChI=1S/C19H15ClF3N3O4S/c1-29-13-5-3-12(4-6-13)26-17(18(28)30-25-26)31-9-8-16(27)24-15-7-2-11(20)10-14(15)19(21,22)23/h2-7,10H,8-9H2,1H3,(H-,24,25,27,28) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3C(F)(F)F)Cl | |
| AKOS005252217 | 473.853 | C19 H15 Cl F3 N3 O4 S | LIKDMUYYOFFQGN-UHFFFAOYSA-N | InChI=1S/C19H15ClF3N3O4S/c1-29-13-5-3-12(4-6-13)26-17(18(28)30-25-26)31-9-8-16(27)24-15-10-11(19(21,22)23)2-7-14(15)20/h2-7,10H,8-9H2,1H3,(H-,24,25,27,28) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cc(ccc3Cl)C(F)(F)F | |
| AKOS005253278 | 398.8 | C19 H15 Cl N4 O4 | YKFOBNJJQRJPCR-UHFFFAOYSA-N | InChI=1S/C19H15ClN4O4/c20-12-6-8-13(9-7-12)23-17(25)10-15(18(23)26)21-11-16-19(27)28-22-24(16)14-4-2-1-3-5-14/h1-9,15,21H,10-11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)Cl | |
| AKOS005250330 | 404.247 | C19 H15 Cl2 N3 O3 | QOVRNTBBZFQXRG-UHFFFAOYSA-N | InChI=1S/C19H15Cl2N3O3/c20-12-6-9-15(16(21)10-12)18(25)23(13-7-8-13)11-17-19(26)27-22-24(17)14-4-2-1-3-5-14/h1-6,9-10,13H,7-8,11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4ccc(cc4Cl)Cl | |
| AKOS005253168 | 382.345 | C19 H15 F N4 O4 | KATRDDXNZXCNHC-UHFFFAOYSA-N | InChI=1S/C19H15FN4O4/c20-12-6-8-13(9-7-12)23-17(25)10-15(18(23)26)21-11-16-19(27)28-22-24(16)14-4-2-1-3-5-14/h1-9,15,21H,10-11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)F | |
| AKOS005252744 | 448.422 | C19 H15 F3 N6 O2 S | IACJJSTZPHVVSR-UHFFFAOYSA-N | InChI=1S/C19H15F3N6O2S/c1-27(2)28-10-17(30-26-28)25-16(29)11-31-18-13(9-23)14(19(20,21)22)8-15(24-18)12-6-4-3-5-7-12/h3-8,10H,11H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)C(F)(F)F)C#N | |
| AKOS005252950 | 496.486 | C19 H15 F3 N6 O3 S2 | UGEDCTLPDCTZAG-UHFFFAOYSA-N | InChI=1S/C19H15F3N6O3S2/c20-19(21,22)13-8-14(15-2-1-7-32-15)24-18(12(13)9-23)33-11-16(29)25-17-10-28(26-31-17)27-3-5-30-6-4-27/h1-2,7-8,10H,3-6,11H2 | c1cc(sc1)c2cc(c(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)C#N)C(F)(F)F | |
| AKOS005251998 | 457.399 | C19 H15 F4 N3 O4 S | OREVQNIDXPSYFC-UHFFFAOYSA-N | InChI=1S/C19H15F4N3O4S/c1-3-13(17(27)24-16-14(22)11(20)8-12(21)15(16)23)31-18-19(28)30-25-26(18)9-4-6-10(29-2)7-5-9/h4-8,13H,3H2,1-2H3,(H-,24,25,27,28) | CCC(C(=O)Nc1c(c(cc(c1F)F)F)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005253286 | 490.251 | C19 H15 I N4 O4 | VHCYZLQYATWMRP-UHFFFAOYSA-N | InChI=1S/C19H15IN4O4/c20-12-6-8-13(9-7-12)23-17(25)10-15(18(23)26)21-11-16-19(27)28-22-24(16)14-4-2-1-3-5-14/h1-9,15,21H,10-11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)I | |
| AKOS005252597 | 393.419 | C19 H15 N5 O3 S | UCGDZFOMWOFFEH-UHFFFAOYSA-N | InChI=1S/C19H15N5O3S/c1-23-11-17(27-22-23)21-16(25)12-28-19-20-15-10-6-5-9-14(15)18(26)24(19)13-7-3-2-4-8-13/h2-11H,12H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3c(=O)n2c4ccccc4 | |
| AKOS005252510 | 425.484 | C19 H15 N5 O3 S2 | VKQAZULIYZHGMC-XNTDXEJSSA-N | InChI=1S/C19H15N5O3S2/c1-23-11-17(27-22-23)21-16(25)12-29-19-20-15(10-14-8-5-9-28-14)18(26)24(19)13-6-3-2-4-7-13/h2-11H,12H2,1H3/b15-10+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccs3)/C(=O)N2c4ccccc4 | |
| AKOS005252476 | 409.418 | C19 H15 N5 O4 S | AXVQEWQZZSADGJ-XNTDXEJSSA-N | InChI=1S/C19H15N5O4S/c1-23-11-17(28-22-23)21-16(25)12-29-19-20-15(10-14-8-5-9-27-14)18(26)24(19)13-6-3-2-4-7-13/h2-11H,12H2,1H3/b15-10+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccco3)/C(=O)N2c4ccccc4 | |
| AKOS005253275 | 409.352 | C19 H15 N5 O6 | LHUZSUPKFSBPMD-UHFFFAOYSA-N | InChI=1S/C19H15N5O6/c25-17-10-15(18(26)22(17)12-6-8-14(9-7-12)24(28)29)20-11-16-19(27)30-21-23(16)13-4-2-1-3-5-13/h1-9,15,20H,10-11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)N(=O)=O | |
| AKOS005252456 | 405.433 | C19 H15 N7 O2 S | MXJZPUOOHZGPGA-UHFFFAOYSA-N | InChI=1S/C19H15N7O2S/c1-2-26-10-16(28-25-26)23-15(27)11-29-19-14(9-21)17(12-6-4-3-5-7-12)13(8-20)18(22)24-19/h3-7,10H,2,11H2,1H3,(H2-,22,23,24,25,27) | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3ccccc3)C#N | |
| AKOS005252537 | 405.433 | C19 H15 N7 O2 S | PWRSBZKURGXUHJ-UHFFFAOYSA-N | InChI=1S/C19H15N7O2S/c1-11-3-5-12(6-4-11)17-13(7-20)18(22)24-19(14(17)8-21)29-10-15(27)23-16-9-26(2)25-28-16/h3-6,9H,10H2,1-2H3,(H2-,22,23,24,25,27) | Cc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)C)N)C#N | |
| AKOS005252691 | 405.433 | C19 H15 N7 O2 S | WBRMQFYDQSNYIE-UHFFFAOYSA-N | InChI=1S/C19H15N7O2S/c1-25(2)26-9-15(28-24-26)20-14(27)10-29-19-21-17-12-7-3-5-11-6-4-8-13(16(11)12)18(17)22-23-19/h3-9H,10H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2nc-3c(nn2)-c4cccc5c4c3ccc5 | |
| AKOS005253185 | 421.432 | C19 H15 N7 O3 S | RGWGWDVUSPSOPW-UHFFFAOYSA-N | InChI=1S/C19H15N7O3S/c1-10(17(27)23-11-6-4-3-5-7-11)30-18-13(9-21)14(12(8-20)16(22)24-18)15-19(28)29-25-26(15)2/h3-7,10H,1-2H3,(H3-,22,23,24,25,27,28) | CC(C(=O)Nc1ccccc1)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253423 | 421.432 | C19 H15 N7 O3 S | PSHIITHUUJDBFC-UHFFFAOYSA-N | InChI=1S/C19H15N7O3S/c1-8-4-3-5-9(6-8)23-17(27)15-13(21)12-11(14-19(28)29-25-26(14)2)10(7-20)16(22)24-18(12)30-15/h3-6H,1-2H3,(H5-,21,22,23,24,25,27,28) | Cc1cccc(c1)NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N | |
| AKOS005253424 | 421.432 | C19 H15 N7 O3 S | CSSKMIWDZYQPLT-UHFFFAOYSA-N | InChI=1S/C19H15N7O3S/c1-8-3-5-9(6-4-8)23-17(27)15-13(21)12-11(14-19(28)29-25-26(14)2)10(7-20)16(22)24-18(12)30-15/h3-6H,1-2H3,(H5-,21,22,23,24,25,27,28) | Cc1ccc(cc1)NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N | |
| AKOS005253542 | 421.432 | C19 H15 N7 O3 S | HCFUGDYEFQJCBC-UHFFFAOYSA-N | InChI=1S/C19H15N7O3S/c1-8-5-3-4-6-10(8)23-17(27)15-13(21)12-11(14-19(28)29-25-26(14)2)9(7-20)16(22)24-18(12)30-15/h3-6H,1-2H3,(H5-,21,22,23,24,25,27,28) | Cc1ccccc1NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N | |
| AKOS005253549 | 421.432 | C19 H15 N7 O3 S | GFXZOWDHPYGUKQ-UHFFFAOYSA-N | InChI=1S/C19H15N7O3S/c1-10-4-3-5-11(6-10)23-14(27)9-30-18-13(8-21)15(12(7-20)17(22)24-18)16-19(28)29-25-26(16)2/h3-6H,9H2,1-2H3,(H3-,22,23,24,25,27,28) | Cc1cccc(c1)NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253550 | 421.432 | C19 H15 N7 O3 S | FPEIQTHJXHKTQP-UHFFFAOYSA-N | InChI=1S/C19H15N7O3S/c1-10-3-5-11(6-4-10)23-14(27)9-30-18-13(8-21)15(12(7-20)17(22)24-18)16-19(28)29-25-26(16)2/h3-6H,9H2,1-2H3,(H3-,22,23,24,25,27,28) | Cc1ccc(cc1)NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253666 | 421.432 | C19 H15 N7 O3 S | VYCNILCBCOKHPU-UHFFFAOYSA-N | InChI=1S/C19H15N7O3S/c1-10-5-3-4-6-13(10)23-14(27)9-30-18-12(8-21)15(11(7-20)17(22)24-18)16-19(28)29-25-26(16)2/h3-6H,9H2,1-2H3,(H3-,22,23,24,25,27,28) | Cc1ccccc1NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253428 | 437.432 | C19 H15 N7 O4 S | ZJULRUABSYVYLY-UHFFFAOYSA-N | InChI=1S/C19H15N7O4S/c1-26-14(19(28)30-25-26)11-8(7-20)16(22)24-18-12(11)13(21)15(31-18)17(27)23-9-5-3-4-6-10(9)29-2/h3-6H,1-2H3,(H5-,21,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccccc4OC)N)N)C#N | |
| AKOS005253429 | 437.432 | C19 H15 N7 O4 S | MJYACUPGSIFHIO-UHFFFAOYSA-N | InChI=1S/C19H15N7O4S/c1-26-14(19(28)30-25-26)11-10(7-20)16(22)24-18-12(11)13(21)15(31-18)17(27)23-8-4-3-5-9(6-8)29-2/h3-6H,1-2H3,(H5-,21,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4cccc(c4)OC)N)N)C#N | |
| AKOS005253430 | 437.432 | C19 H15 N7 O4 S | BKAIEDWMDZOCII-UHFFFAOYSA-N | InChI=1S/C19H15N7O4S/c1-26-14(19(28)30-25-26)11-10(7-20)16(22)24-18-12(11)13(21)15(31-18)17(27)23-8-3-5-9(29-2)6-4-8/h3-6H,1-2H3,(H5-,21,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(cc4)OC)N)N)C#N | |
| AKOS005253558 | 437.432 | C19 H15 N7 O4 S | XBUVLSZPVLFKGO-UHFFFAOYSA-N | InChI=1S/C19H15N7O4S/c1-26-16(19(28)30-25-26)15-10(7-20)17(22)24-18(11(15)8-21)31-9-14(27)23-12-5-3-4-6-13(12)29-2/h3-6H,9H2,1-2H3,(H3-,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccccc3OC)N)C#N | |
| AKOS005253559 | 437.432 | C19 H15 N7 O4 S | YJASZMHFEBGLJE-UHFFFAOYSA-N | InChI=1S/C19H15N7O4S/c1-26-16(19(28)30-25-26)15-12(7-20)17(22)24-18(13(15)8-21)31-9-14(27)23-10-4-3-5-11(6-10)29-2/h3-6H,9H2,1-2H3,(H3-,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3cccc(c3)OC)N)C#N | |
| AKOS005253560 | 437.432 | C19 H15 N7 O4 S | FGVLKEPHXONJHT-UHFFFAOYSA-N | InChI=1S/C19H15N7O4S/c1-26-16(19(28)30-25-26)15-12(7-20)17(22)24-18(13(15)8-21)31-9-14(27)23-10-3-5-11(29-2)6-4-10/h3-6H,9H2,1-2H3,(H3-,22,23,24,25,27,28) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(cc3)OC)N)C#N | |
| AKOS005250301 | 369.802 | C19 H16 Cl N3 O3 | FTBPBRTUJYURDB-UHFFFAOYSA-N | InChI=1S/C19H16ClN3O3/c20-14-6-4-5-13(11-14)18(24)22(15-9-10-15)12-17-19(25)26-21-23(17)16-7-2-1-3-8-16/h1-8,11,15H,9-10,12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4cccc(c4)Cl | |
| AKOS005251991 | 433.865 | C19 H16 Cl N3 O5 S | XGJQNVCBVCUOJE-UHFFFAOYSA-N | InChI=1S/C19H16ClN3O5S/c1-2-15(16(24)21-11-8-9-14(20)13(10-11)18(25)26)29-17-19(27)28-22-23(17)12-6-4-3-5-7-12/h3-10,15H,2H2,1H3,(H2-,21,22,24,25,26,27) | CCC(C(=O)Nc1ccc(c(c1)C(=O)O)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252000 | 433.865 | C19 H16 Cl N3 O5 S | IYQHWGKDVRDNPE-UHFFFAOYSA-N | InChI=1S/C19H16ClN3O5S/c1-2-15(16(24)21-14-10-11(18(25)26)8-9-13(14)20)29-17-19(27)28-22-23(17)12-6-4-3-5-7-12/h3-10,15H,2H2,1H3,(H2-,21,22,24,25,26,27) | CCC(C(=O)Nc1cc(ccc1Cl)C(=O)O)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251814 | 449.865 | C19 H16 Cl N3 O6 S | INERDGZHEULQFD-UHFFFAOYSA-N | InChI=1S/C19H16ClN3O6S/c1-10(16(24)21-11-3-8-15(20)14(9-11)18(25)26)30-17-19(27)29-22-23(17)12-4-6-13(28-2)7-5-12/h3-10H,1-2H3,(H2-,21,22,24,25,26,27) | CC(C(=O)Nc1ccc(c(c1)C(=O)O)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251815 | 449.865 | C19 H16 Cl N3 O6 S | ZMYWRXCSWYHHJB-UHFFFAOYSA-N | InChI=1S/C19H16ClN3O6S/c1-10(16(24)21-15-9-11(18(25)26)3-8-14(15)20)30-17-19(27)29-22-23(17)12-4-6-13(28-2)7-5-12/h3-10H,1-2H3,(H2-,21,22,24,25,26,27) | CC(C(=O)Nc1cc(ccc1Cl)C(=O)O)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252165 | 449.865 | C19 H16 Cl N3 O6 S | FWBOVPKJISKHCN-UHFFFAOYSA-N | InChI=1S/C19H16ClN3O6S/c1-28-13-5-3-12(4-6-13)23-17(19(27)29-22-23)30-9-8-16(24)21-11-2-7-15(20)14(10-11)18(25)26/h2-7,10H,8-9H2,1H3,(H2-,21,22,24,25,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(c(c3)C(=O)O)Cl | |
| AKOS005252166 | 449.865 | C19 H16 Cl N3 O6 S | CATNERVNWPMGIQ-UHFFFAOYSA-N | InChI=1S/C19H16ClN3O6S/c1-28-13-5-3-12(4-6-13)23-17(19(27)29-22-23)30-9-8-16(24)21-15-10-11(18(25)26)2-7-14(15)20/h2-7,10H,8-9H2,1H3,(H2-,21,22,24,25,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cc(ccc3Cl)C(=O)O | |
| AKOS005252871 | 413.881 | C19 H16 Cl N5 O2 S | GWQJOGZTEVWTBH-UHFFFAOYSA-N | InChI=1S/C19H16ClN5O2S/c1-12(2)25-10-18(27-24-25)23-17(26)11-28-19-14(9-21)5-8-16(22-19)13-3-6-15(20)7-4-13/h3-8,10,12H,11H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)c3ccc(cc3)Cl)C#N | |
| AKOS005253312 | 429.88 | C19 H16 Cl N5 O3 S | JPSRPFGWALCVNS-UHFFFAOYSA-N | InChI=1S/C19H16ClN5O3S/c1-27-9-8-25-11-18(28-24-25)23-17(26)12-29-19-14(10-21)4-7-16(22-19)13-2-5-15(20)6-3-13/h2-7,11H,8-9,12H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)c3ccc(cc3)Cl)C#N | |
| AKOS005250276 | 353.347 | C19 H16 F N3 O3 | KBRARCZGVLTBCD-UHFFFAOYSA-N | InChI=1S/C19H16FN3O3/c20-16-9-5-4-8-15(16)18(24)22(13-10-11-13)12-17-19(25)26-21-23(17)14-6-2-1-3-7-14/h1-9,13H,10-12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4ccccc4F | |
| AKOS005250277 | 353.347 | C19 H16 F N3 O3 | XDQVTJVTMIJSJR-UHFFFAOYSA-N | InChI=1S/C19H16FN3O3/c20-14-8-6-13(7-9-14)18(24)22(15-10-11-15)12-17-19(25)26-21-23(17)16-4-2-1-3-5-16/h1-9,15H,10-12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4ccc(cc4)F | |
| AKOS005251701 | 423.409 | C19 H16 F3 N3 O3 S | LPBFWBOZYJNXLM-UHFFFAOYSA-N | InChI=1S/C19H16F3N3O3S/c1-2-15(16(26)23-14-11-7-6-10-13(14)19(20,21)22)29-17-18(27)28-24-25(17)12-8-4-3-5-9-12/h3-11,15H,2H2,1H3,(H-,23,24,26,27) | CCC(C(=O)Nc1ccccc1C(F)(F)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251716 | 423.409 | C19 H16 F3 N3 O3 S | IREHJIYMOGYXDI-UHFFFAOYSA-N | InChI=1S/C19H16F3N3O3S/c1-2-15(16(26)23-13-8-6-7-12(11-13)19(20,21)22)29-17-18(27)28-24-25(17)14-9-4-3-5-10-14/h3-11,15H,2H2,1H3,(H-,23,24,26,27) | CCC(C(=O)Nc1cccc(c1)C(F)(F)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251779 | 439.408 | C19 H16 F3 N3 O4 S | UIVUZSUYXNUFRX-UHFFFAOYSA-N | InChI=1S/C19H16F3N3O4S/c1-11(16(26)23-15-6-4-3-5-14(15)19(20,21)22)30-17-18(27)29-24-25(17)12-7-9-13(28-2)10-8-12/h3-11H,1-2H3,(H-,23,24,26,27) | CC(C(=O)Nc1ccccc1C(F)(F)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251780 | 439.408 | C19 H16 F3 N3 O4 S | RZNPXUKIKLNXIV-UHFFFAOYSA-N | InChI=1S/C19H16F3N3O4S/c1-11(16(26)23-13-5-3-4-12(10-13)19(20,21)22)30-17-18(27)29-24-25(17)14-6-8-15(28-2)9-7-14/h3-11H,1-2H3,(H-,23,24,26,27) | CC(C(=O)Nc1cccc(c1)C(F)(F)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251950 | 439.408 | C19 H16 F3 N3 O4 S | ATPJIHVCNAFFMW-UHFFFAOYSA-N | InChI=1S/C19H16F3N3O4S/c1-2-15(16(26)23-12-8-10-14(11-9-12)28-19(20,21)22)30-17-18(27)29-24-25(17)13-6-4-3-5-7-13/h3-11,15H,2H2,1H3,(H-,23,24,26,27) | CCC(C(=O)Nc1ccc(cc1)OC(F)(F)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251958 | 439.408 | C19 H16 F3 N3 O4 S | ZJQCNHXKGWSEEY-UHFFFAOYSA-N | InChI=1S/C19H16F3N3O4S/c1-2-15(16(26)23-13-10-6-7-11-14(13)28-19(20,21)22)30-17-18(27)29-24-25(17)12-8-4-3-5-9-12/h3-11,15H,2H2,1H3,(H-,23,24,26,27) | CCC(C(=O)Nc1ccccc1OC(F)(F)F)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252184 | 439.408 | C19 H16 F3 N3 O4 S | CHHXEPWKZZYAIE-UHFFFAOYSA-N | InChI=1S/C19H16F3N3O4S/c1-28-13-8-6-12(7-9-13)25-17(18(27)29-24-25)30-11-10-16(26)23-15-5-3-2-4-14(15)19(20,21)22/h2-9H,10-11H2,1H3,(H-,23,24,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccccc3C(F)(F)F | |
| AKOS005252191 | 439.408 | C19 H16 F3 N3 O4 S | NAPATFFRDZDRAE-UHFFFAOYSA-N | InChI=1S/C19H16F3N3O4S/c1-28-15-7-5-14(6-8-15)25-17(18(27)29-24-25)30-10-9-16(26)23-13-4-2-3-12(11-13)19(20,21)22/h2-8,11H,9-10H2,1H3,(H-,23,24,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cccc(c3)C(F)(F)F | |
| AKOS005251840 | 455.408 | C19 H16 F3 N3 O5 S | MZDWPVVYYHNACJ-UHFFFAOYSA-N | InChI=1S/C19H16F3N3O5S/c1-11(16(26)23-12-3-7-15(8-4-12)29-19(20,21)22)31-17-18(27)30-24-25(17)13-5-9-14(28-2)10-6-13/h3-11H,1-2H3,(H-,23,24,26,27) | CC(C(=O)Nc1ccc(cc1)OC(F)(F)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251841 | 455.408 | C19 H16 F3 N3 O5 S | XVENXSBRMGBTKL-UHFFFAOYSA-N | InChI=1S/C19H16F3N3O5S/c1-11(16(26)23-14-5-3-4-6-15(14)29-19(20,21)22)31-17-18(27)30-24-25(17)12-7-9-13(28-2)10-8-12/h3-11H,1-2H3,(H-,23,24,26,27) | CC(C(=O)Nc1ccccc1OC(F)(F)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252181 | 455.408 | C19 H16 F3 N3 O5 S | UUXHGGKINHXRJD-UHFFFAOYSA-N | InChI=1S/C19H16F3N3O5S/c1-28-14-8-4-13(5-9-14)25-17(18(27)30-24-25)31-11-10-16(26)23-12-2-6-15(7-3-12)29-19(20,21)22/h2-9H,10-11H2,1H3,(H-,23,24,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)OC(F)(F)F | |
| AKOS005252182 | 455.408 | C19 H16 F3 N3 O5 S | LLLFWROBUJUCED-UHFFFAOYSA-N | InChI=1S/C19H16F3N3O5S/c1-28-13-8-6-12(7-9-13)25-17(18(27)30-24-25)31-11-10-16(26)23-14-4-2-3-5-15(14)29-19(20,21)22/h2-9H,10-11H2,1H3,(H-,23,24,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccccc3OC(F)(F)F | |
| AKOS005219511 | 380.42 | C19 H16 N4 O3 S | AOHVJSRZXBLDGZ-UHFFFAOYSA-N | InChI=1S/C19H16N4O3S/c1-12(2)15-9-8-13(10-20)18(21-15)27-11-16(24)17-19(25)26-22-23(17)14-6-4-3-5-7-14/h3-9,12H,11H2,1-2H3 | CC(C)c1ccc(c(n1)SCC(=O)c2c(on[n+]2c3ccccc3)[O-])C#N | |
| AKOS005219513 | 380.42 | C19 H16 N4 O3 S | STQBEICVLUQBOH-UHFFFAOYSA-N | InChI=1S/C19H16N4O3S/c1-2-6-14-10-9-13(11-20)18(21-14)27-12-16(24)17-19(25)26-22-23(17)15-7-4-3-5-8-15/h3-5,7-10H,2,6,12H2,1H3 | CCCc1ccc(c(n1)SCC(=O)c2c(on[n+]2c3ccccc3)[O-])C#N | |
| AKOS005250606 | 380.42 | C19 H16 N4 O3 S | IOSZRLNKPCJSDD-UHFFFAOYSA-N | InChI=1S/C19H16N4O3S/c1-23-16(19(25)26-22-23)17(24)21-18-14(10-20)13-8-7-12(9-15(13)27-18)11-5-3-2-4-6-11/h2-6,12H,7-9H2,1H3,(H-,21,22,24,25) | C[n+]1c(c(on1)[O-])C(=O)Nc2c(c3c(s2)CC(CC3)c4ccccc4)C#N | |
| AKOS005250798 | 380.42 | C19 H16 N4 O3 S | HWNGSIRNRLINGX-UHFFFAOYSA-N | InChI=1S/C19H16N4O3S/c1-11-12(2)15(9-20)18(21-13(11)3)27-10-16(24)17-19(25)26-22-23(17)14-7-5-4-6-8-14/h4-8H,10H2,1-3H3 | Cc1c(c(c(nc1C)SCC(=O)c2c(on[n+]2c3ccccc3)[O-])C#N)C | |
| AKOS005251775 | 380.42 | C19 H16 N4 O3 S | LJMVILLGLIFZHM-UHFFFAOYSA-N | InChI=1S/C19H16N4O3S/c1-12(17(24)21-14-7-8-16-13(11-14)9-10-20-16)27-18-19(25)26-22-23(18)15-5-3-2-4-6-15/h2-12,22,25H,1H3 | CC(C(=O)Nc1ccc2c(c1)cc[nH]2)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252168 | 380.42 | C19 H16 N4 O3 S | BCRQEOSCFGBUBJ-UHFFFAOYSA-N | InChI=1S/C19H16N4O3S/c24-17(21-14-6-7-16-13(12-14)8-10-20-16)9-11-27-18-19(25)26-22-23(18)15-4-2-1-3-5-15/h1-8,10,12,22,25H,9,11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc4c(c3)cc[nH]4 | |
| AKOS005253745 | 380.42 | C19 H16 N4 O3 S | KILOODZBCNWOPJ-UHFFFAOYSA-N | InChI=1S/C19H16N4O3S/c1-9-10(2)13-14(20)17(27-18(13)21-11(9)3)16(24)15-19(25)26-22-23(15)12-7-5-4-6-8-12/h4-8H,1-3H3,(H2-,20,22,24,25) | Cc1c(c2c(c(sc2nc1C)C(=O)c3c(on[n+]3c4ccccc4)[O-])N)C | |
| AKOS005253787 | 380.42 | C19 H16 N4 O3 S | PQXBIPOPCAWEMQ-UHFFFAOYSA-N | InChI=1S/C19H16N4O3S/c1-2-6-11-9-10-13-14(20)17(27-18(13)21-11)16(24)15-19(25)26-22-23(15)12-7-4-3-5-8-12/h3-5,7-10H,2,6H2,1H3,(H2-,20,22,24,25) | CCCc1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccccc4)[O-])N | |
| AKOS005253791 | 380.42 | C19 H16 N4 O3 S | YJNGBNLJPJMGEH-UHFFFAOYSA-N | InChI=1S/C19H16N4O3S/c1-10(2)13-9-8-12-14(20)17(27-18(12)21-13)16(24)15-19(25)26-22-23(15)11-6-4-3-5-7-11/h3-10H,1-2H3,(H2-,20,22,24,25) | CC(C)c1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccccc4)[O-])N | |
| AKOS005253886 | 380.42 | C19 H16 N4 O3 S | NDZBAPKOGJYZRS-UHFFFAOYSA-N | InChI=1S/C19H16N4O3S/c1-9-4-6-11(7-5-9)14-10(2)8-12-13(20)17(27-18(12)21-14)16(24)15-19(25)26-22-23(15)3/h4-8H,1-3H3,(H2-,20,22,24,25) | Cc1ccc(cc1)c2c(cc3c(c(sc3n2)C(=O)c4c(on[n+]4C)[O-])N)C | |
| AKOS005251595 | 412.485 | C19 H16 N4 O3 S2 | LZQZMPSEPKMCJJ-UHFFFAOYSA-N | InChI=1S/C19H16N4O3S2/c20-10-14-13-8-4-5-9-15(13)28-17(14)21-16(24)11-27-18-19(25)26-22-23(18)12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-9,11H2,(H-,21,22,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3c(c4c(s3)CCCC4)C#N | |
| AKOS005253282 | 364.355 | C19 H16 N4 O4 | UNHQLMVMOQJLNU-UHFFFAOYSA-N | InChI=1S/C19H16N4O4/c24-17-11-15(18(25)22(17)13-7-3-1-4-8-13)20-12-16-19(26)27-21-23(16)14-9-5-2-6-10-14/h1-10,15,20H,11-12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccccc4 | |
| AKOS005250109 | 396.42 | C19 H16 N4 O4 S | AMVYNRARNDOPMU-UHFFFAOYSA-O | InChI=1S/C19H14N4O4S/c1-26-14-9-7-13(8-10-14)23-16(18(25)27-21-23)11-15-17(24)22(19(28)20-15)12-5-3-2-4-6-12/h2-11H,1H3,(H,24,28)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C\3/C(=O)N(=C(N3)S)c4ccccc4 | |
| AKOS005250178 | 396.42 | C19 H16 N4 O4 S | MVWYRAWDDKMBLO-UHFFFAOYSA-N | InChI=1S/C19H16N4O4S/c1-26-12-8-6-11(7-9-12)23-16(19(25)27-22-23)17(24)21-18-14(10-20)13-4-2-3-5-15(13)28-18/h6-9H,2-5H2,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3c(c4c(s3)CCCC4)C#N | |
| AKOS005250414 | 396.42 | C19 H16 N4 O4 S | DGXUVPYRQXUWRV-UHFFFAOYSA-N | InChI=1S/C19H16N4O4S/c1-11-8-12(2)21-18(15(11)9-20)28-10-16(24)17-19(25)27-22-23(17)13-4-6-14(26-3)7-5-13/h4-8H,10H2,1-3H3 | Cc1cc(nc(c1C#N)SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005251477 | 396.42 | C19 H16 N4 O4 S | OLGCOJDFZOIYKU-UHFFFAOYSA-N | InChI=1S/C19H16N4O4S/c1-11(28-18-19(25)27-22-23(18)2)16(24)20-13-9-7-12(8-10-13)17-21-14-5-3-4-6-15(14)26-17/h3-11H,1-2H3,(H-,20,21,22,24,25) | CC(C(=O)Nc1ccc(cc1)c2nc3ccccc3o2)Sc4c(on[n+]4C)[O-] | |
| AKOS005251614 | 396.42 | C19 H16 N4 O4 S | YSBYJYVGDXJDRY-UHFFFAOYSA-N | InChI=1S/C19H16N4O4S/c1-26-15-5-3-14(4-6-15)23-18(19(25)27-22-23)28-11-17(24)21-13-2-7-16-12(10-13)8-9-20-16/h2-10,22,25H,11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc4c(c3)cc[nH]4 | |
| AKOS005252312 | 396.42 | C19 H16 N4 O4 S | QOHDDRKTLKFZMB-UHFFFAOYSA-N | InChI=1S/C19H16N4O4S/c1-23-18(19(25)27-22-23)28-11-10-16(24)20-13-8-6-12(7-9-13)17-21-14-4-2-3-5-15(14)26-17/h2-9H,10-11H2,1H3,(H-,20,21,22,24,25) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2ccc(cc2)c3nc4ccccc4o3 | |
| AKOS005253739 | 396.42 | C19 H16 N4 O4 S | WJVZQKQJJAXKLU-UHFFFAOYSA-N | InChI=1S/C19H16N4O4S/c1-9-8-10(2)21-18-13(9)14(20)17(28-18)16(24)15-19(25)27-22-23(15)11-4-6-12(26-3)7-5-11/h4-8H,1-3H3,(H2-,20,22,24,25) | Cc1cc(nc2c1c(c(s2)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N)C | |
| AKOS005253740 | 396.42 | C19 H16 N4 O4 S | IWJFMYXMCWQNMW-UHFFFAOYSA-N | InChI=1S/C19H16N4O4S/c1-9-8-13-14(20)17(28-18(13)21-10(9)2)16(24)15-19(25)27-22-23(15)11-4-6-12(26-3)7-5-11/h4-8H,1-3H3,(H2-,20,22,24,25) | Cc1cc2c(c(sc2nc1C)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N | |
| AKOS005253860 | 428.485 | C19 H16 N4 O4 S2 | HGKLCGFJTAUXSX-UHFFFAOYSA-N | InChI=1S/C19H16N4O4S2/c1-7-5-6-10(28-7)12-11(9(3)24)8(2)21-18-13(12)14(20)17(29-18)16(25)15-19(26)27-22-23(15)4/h5-6H,1-4H3,(H2-,20,22,25,26) | Cc1ccc(s1)c2c3c(c(sc3nc(c2C(=O)C)C)C(=O)c4c(on[n+]4C)[O-])N | |
| AKOS005250324 | 380.354 | C19 H16 N4 O5 | ISWXZCISVRZKDV-UHFFFAOYSA-N | InChI=1S/C19H16N4O5/c24-18(13-5-4-8-16(11-13)23(26)27)21(14-9-10-14)12-17-19(25)28-20-22(17)15-6-2-1-3-7-15/h1-8,11,14H,9-10,12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4cccc(c4)[N+](=O)[O-] | |
| AKOS005250325 | 380.354 | C19 H16 N4 O5 | HXDPMNMAOFEWBC-UHFFFAOYSA-N | InChI=1S/C19H16N4O5/c24-18(13-6-8-16(9-7-13)23(26)27)21(14-10-11-14)12-17-19(25)28-20-22(17)15-4-2-1-3-5-15/h1-9,14H,10-12H2/q-2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4ccc(cc4)[N-](=O)[O-] | |
| AKOS005215536 | 412.419 | C19 H16 N4 O5 S | GZVHTKQZCWTCJJ-UHFFFAOYSA-N | InChI=1S/C19H16N4O5S/c1-12(2)22-19(29-16-9-8-15(23(26)27)10-14(16)11-24)18(28-21-22)20-17(25)13-6-4-3-5-7-13/h3-12H,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)Sc3ccc(cc3C=O)N(=O)=O | |
| AKOS005252729 | 420.448 | C19 H16 N8 O2 S | GWUCAHODTCDWNQ-UHFFFAOYSA-N | InChI=1S/C19H16N8O2S/c1-26(2)27-10-16(29-25-27)23-15(28)11-30-19-14(9-21)17(12-6-4-3-5-7-12)13(8-20)18(22)24-19/h3-7,10H,11H2,1-2H3,(H2-,22,23,24,25,28) | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3ccccc3)C#N | |
| AKOS005252957 | 468.512 | C19 H16 N8 O3 S2 | PSVMUQBNJFWARE-UHFFFAOYSA-N | InChI=1S/C19H16N8O3S2/c20-8-12-17(14-2-1-7-31-14)13(9-21)19(24-18(12)22)32-11-15(28)23-16-10-27(25-30-16)26-3-5-29-6-4-26/h1-2,7,10H,3-6,11H2,(H2-,22,23,24,25,28) | c1cc(sc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)N)C#N | |
| AKOS005252963 | 452.447 | C19 H16 N8 O4 S | FLEAPSHJRDNRAI-UHFFFAOYSA-N | InChI=1S/C19H16N8O4S/c20-8-12-17(14-2-1-5-30-14)13(9-21)19(24-18(12)22)32-11-15(28)23-16-10-27(25-31-16)26-3-6-29-7-4-26/h1-2,5,10H,3-4,6-7,11H2,(H2-,22,23,24,25,28) | c1cc(oc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)N)C#N | |
| AKOS005253188 | 500.511 | C19 H16 N8 O5 S2 | NAOCOUXXJPQQPC-UHFFFAOYSA-N | InChI=1S/C19H16N8O5S2/c1-9(17(28)24-10-3-5-11(6-4-10)34(23,30)31)33-18-13(8-21)14(12(7-20)16(22)25-18)15-19(29)32-26-27(15)2/h3-6,9H,1-2H3,(H5-,22,23,24,25,26,28,29,30,31) | CC(C(=O)Nc1ccc(cc1)S(=O)(=O)N)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005251695 | 482.323 | C19 H17 Br F N3 O4 S | LUVGNIRJYCDOFM-UHFFFAOYSA-N | InChI=1S/C19H17BrFN3O4S/c1-3-16(17(25)22-15-9-4-11(20)10-14(15)21)29-18-19(26)28-23-24(18)12-5-7-13(27-2)8-6-12/h4-10,16H,3H2,1-2H3,(H-,22,23,25,26) | CCC(C(=O)Nc1ccc(cc1F)Br)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251702 | 437.872 | C19 H17 Cl F N3 O4 S | KBRFTFNRGPAQNA-UHFFFAOYSA-N | InChI=1S/C19H17ClFN3O4S/c1-3-16(17(25)22-11-4-9-15(21)14(20)10-11)29-18-19(26)28-23-24(18)12-5-7-13(27-2)8-6-12/h4-10,16H,3H2,1-2H3,(H-,22,23,25,26) | CCC(C(=O)Nc1ccc(c(c1)Cl)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252014 | 454.327 | C19 H17 Cl2 N3 O4 S | QKLUXRVTPHKDEU-UHFFFAOYSA-N | InChI=1S/C19H17Cl2N3O4S/c1-3-16(17(25)22-15-9-4-11(20)10-14(15)21)29-18-19(26)28-23-24(18)12-5-7-13(27-2)8-6-12/h4-10,16H,3H2,1-2H3,(H-,22,23,25,26) | CCC(C(=O)Nc1ccc(cc1Cl)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252119 | 454.327 | C19 H17 Cl2 N3 O4 S | NXDBZQMEXDHMOO-UHFFFAOYSA-N | InChI=1S/C19H17Cl2N3O4S/c1-3-16(17(25)22-13-9-11(20)8-12(21)10-13)29-18-19(26)28-23-24(18)14-4-6-15(27-2)7-5-14/h4-10,16H,3H2,1-2H3,(H-,22,23,25,26) | CCC(C(=O)Nc1cc(cc(c1)Cl)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252125 | 454.327 | C19 H17 Cl2 N3 O4 S | INJPFADRBCRTHJ-UHFFFAOYSA-N | InChI=1S/C19H17Cl2N3O4S/c1-3-16(17(25)22-15-10-11(20)4-9-14(15)21)29-18-19(26)28-23-24(18)12-5-7-13(27-2)8-6-12/h4-10,16H,3H2,1-2H3,(H-,22,23,25,26) | CCC(C(=O)Nc1cc(ccc1Cl)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252134 | 454.327 | C19 H17 Cl2 N3 O4 S | GSWKCFRHYPSOHU-UHFFFAOYSA-N | InChI=1S/C19H17Cl2N3O4S/c1-3-16(17(25)22-11-4-9-14(20)15(21)10-11)29-18-19(26)28-23-24(18)12-5-7-13(27-2)8-6-12/h4-10,16H,3H2,1-2H3,(H-,22,23,25,26) | CCC(C(=O)Nc1ccc(c(c1)Cl)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252139 | 454.327 | C19 H17 Cl2 N3 O4 S | ZILLLXIMYHFCMZ-UHFFFAOYSA-N | InChI=1S/C19H17Cl2N3O4S/c1-3-15(17(25)22-14-6-4-5-13(20)16(14)21)29-18-19(26)28-23-24(18)11-7-9-12(27-2)10-8-11/h4-10,15H,3H2,1-2H3,(H-,22,23,25,26) | CCC(C(=O)Nc1cccc(c1Cl)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250479 | 368.362 | C19 H17 F N4 O3 | LIPGFEMNTAAMLM-UHFFFAOYSA-N | InChI=1S/C19H17FN4O3/c20-15-8-4-5-9-16(15)22-10-12-23(13-11-22)18(25)17-19(26)27-21-24(17)14-6-2-1-3-7-14/h1-9H,10-13H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)c4ccccc4F | |
| AKOS005250486 | 368.362 | C19 H17 F N4 O3 | OWVHFTCWLXBEOY-UHFFFAOYSA-N | InChI=1S/C19H17FN4O3/c20-14-6-8-15(9-7-14)22-10-12-23(13-11-22)18(25)17-19(26)27-21-24(17)16-4-2-1-3-5-16/h1-9H,10-13H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)c4ccc(cc4)F | |
| AKOS005251921 | 421.418 | C19 H17 F2 N3 O4 S | GKBAIJJTHIAHSY-UHFFFAOYSA-N | InChI=1S/C19H17F2N3O4S/c1-3-16(17(25)22-11-4-9-14(20)15(21)10-11)29-18-19(26)28-23-24(18)12-5-7-13(27-2)8-6-12/h4-10,16H,3H2,1-2H3,(H-,22,23,25,26) | CCC(C(=O)Nc1ccc(c(c1)F)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005215456 | 335.357 | C19 H17 N3 O3 | JXFZDYQLAOWDQU-UHFFFAOYSA-N | InChI=1S/C19H17N3O3/c1-13(2)22-16(17(23)14-9-5-3-6-10-14)19(25-21-22)20-18(24)15-11-7-4-8-12-15/h3-13H,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)C(=O)c3ccccc3 | |
| AKOS005250379 | 335.357 | C19 H17 N3 O3 | DYDXFWLHHMTYFY-OUKQBFOZSA-N | InChI=1S/C19H17N3O3/c1-21(18(23)13-12-15-8-4-2-5-9-15)14-17-19(24)25-20-22(17)16-10-6-3-7-11-16/h2-13H,14H2,1H3/b13-12+ | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)/C=C/c3ccccc3 | |
| AKOS005250628 | 351.356 | C19 H17 N3 O4 | ZXKUBTRQWRQVMY-UHFFFAOYSA-N | InChI=1S/C19H17N3O4/c1-25-16-8-6-15(7-9-16)22-17(19(24)26-20-22)18(23)21-11-10-13-4-2-3-5-14(13)12-21/h2-9H,10-12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCc4ccccc4C3 | |
| AKOS005251451 | 383.421 | C19 H17 N3 O4 S | FYVMAMOMUYQBAH-UHFFFAOYSA-N | InChI=1S/C19H17N3O4S/c1-12(23)14-8-10-15(11-9-14)20-17(24)13(2)27-18-19(25)26-21-22(18)16-6-4-3-5-7-16/h3-11,13H,1-2H3,(H-,20,21,23,24,25) | CC(C(=O)Nc1ccc(cc1)C(=O)C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252260 | 383.421 | C19 H17 N3 O4 S | BZQOYQLHFCZGIF-UHFFFAOYSA-N | InChI=1S/C19H17N3O4S/c1-13(23)14-7-9-15(10-8-14)20-17(24)11-12-27-18-19(25)26-21-22(18)16-5-3-2-4-6-16/h2-10H,11-12H2,1H3,(H-,20,21,23,24,25) | CC(=O)c1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251159 | 399.42 | C19 H17 N3 O5 S | QDEPOQFOOFUYAX-UHFFFAOYSA-N | InChI=1S/C19H17N3O5S/c1-2-26-18(24)13-8-10-14(11-9-13)20-16(23)12-28-17-19(25)27-21-22(17)15-6-4-3-5-7-15/h3-11H,2,12H2,1H3,(H-,20,21,23,24,25) | CCOC(=O)c1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251533 | 399.42 | C19 H17 N3 O5 S | GTKHSTVGJAQCOQ-UHFFFAOYSA-N | InChI=1S/C19H17N3O5S/c1-12(23)13-3-5-14(6-4-13)20-17(24)11-28-18-19(25)27-21-22(18)15-7-9-16(26-2)10-8-15/h3-10H,11H2,1-2H3,(H-,20,21,23,24,25) | CC(=O)c1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251765 | 399.42 | C19 H17 N3 O5 S | HYKQXBKFFBFCKE-UHFFFAOYSA-N | InChI=1S/C19H17N3O5S/c1-12(16(23)20-15-11-7-6-10-14(15)18(24)26-2)28-17-19(25)27-21-22(17)13-8-4-3-5-9-13/h3-12H,1-2H3,(H-,20,21,23,24,25) | CC(C(=O)Nc1ccccc1C(=O)OC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251770 | 399.42 | C19 H17 N3 O5 S | PPIUCWIYFYJXPK-UHFFFAOYSA-N | InChI=1S/C19H17N3O5S/c1-12(17(23)20-13-7-8-15-16(11-13)26-10-9-25-15)28-18-19(24)27-21-22(18)14-5-3-2-4-6-14/h2-8,11-12H,9-10H2,1H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccc2c(c1)OCCO2)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251880 | 399.42 | C19 H17 N3 O5 S | VSPXADDTABGVAB-UHFFFAOYSA-N | InChI=1S/C19H17N3O5S/c1-11-8-9-13(18(24)25)10-15(11)20-16(23)12(2)28-17-19(26)27-21-22(17)14-6-4-3-5-7-14/h3-10,12H,1-2H3,(H2-,20,21,23,24,25,26) | Cc1ccc(cc1NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-])C(=O)O | |
| AKOS005251892 | 399.42 | C19 H17 N3 O5 S | JOKKHRUQBMHJOR-UHFFFAOYSA-N | InChI=1S/C19H17N3O5S/c1-2-15(16(23)20-13-10-8-12(9-11-13)18(24)25)28-17-19(26)27-21-22(17)14-6-4-3-5-7-14/h3-11,15H,2H2,1H3,(H2-,20,21,23,24,25,26) | CCC(C(=O)Nc1ccc(cc1)C(=O)O)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251935 | 399.42 | C19 H17 N3 O5 S | TZNJJTSMPMSXFN-UHFFFAOYSA-N | InChI=1S/C19H17N3O5S/c1-2-16(17(23)20-12-8-9-14-15(10-12)26-11-25-14)28-18-19(24)27-21-22(18)13-6-4-3-5-7-13/h3-10,16H,2,11H2,1H3,(H-,20,21,23,24) | CCC(C(=O)Nc1ccc2c(c1)OCO2)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251994 | 399.42 | C19 H17 N3 O5 S | UBVIJANEXNRQCG-UHFFFAOYSA-N | InChI=1S/C19H17N3O5S/c1-2-15(16(23)20-13-8-6-7-12(11-13)18(24)25)28-17-19(26)27-21-22(17)14-9-4-3-5-10-14/h3-11,15H,2H2,1H3,(H2-,20,21,23,24,25,26) | CCC(C(=O)Nc1cccc(c1)C(=O)O)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252157 | 399.42 | C19 H17 N3 O5 S | ARRFTAWNCITLBM-UHFFFAOYSA-N | InChI=1S/C19H17N3O5S/c1-12-7-8-13(18(24)25)11-15(12)20-16(23)9-10-28-17-19(26)27-21-22(17)14-5-3-2-4-6-14/h2-8,11H,9-10H2,1H3,(H2-,20,21,23,24,25,26) | Cc1ccc(cc1NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-])C(=O)O | |
| AKOS005252161 | 399.42 | C19 H17 N3 O5 S | MFRQCKSMHGTJQQ-UHFFFAOYSA-N | InChI=1S/C19H17N3O5S/c23-17(20-13-6-7-15-16(12-13)26-10-9-25-15)8-11-28-18-19(24)27-21-22(18)14-4-2-1-3-5-14/h1-7,12H,8-11H2,(H-,20,21,23,24) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc4c(c3)OCCO4 | |
| AKOS005252257 | 399.42 | C19 H17 N3 O5 S | FTAXHFHUCGRBAO-UHFFFAOYSA-N | InChI=1S/C19H17N3O5S/c1-26-18(24)14-9-5-6-10-15(14)20-16(23)11-12-28-17-19(25)27-21-22(17)13-7-3-2-4-8-13/h2-10H,11-12H2,1H3,(H-,20,21,23,24,25) | COC(=O)c1ccccc1NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250122 | 383.355 | C19 H17 N3 O6 | RWRCBJBJFYODAV-UHFFFAOYSA-N | InChI=1S/C19H17N3O6/c1-3-27-18(24)12-4-6-13(7-5-12)20-17(23)16-19(25)28-21-22(16)14-8-10-15(26-2)11-9-14/h4-11H,3H2,1-2H3,(H-,20,21,23,24,25) | CCOC(=O)c1ccc(cc1)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251542 | 415.42 | C19 H17 N3 O6 S | MHSVZDPGFPMABZ-UHFFFAOYSA-N | InChI=1S/C19H17N3O6S/c1-26-13-9-7-12(8-10-13)22-17(19(25)28-21-22)29-11-16(23)20-15-6-4-3-5-14(15)18(24)27-2/h3-10H,11H2,1-2H3,(H-,20,21,23,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccccc3C(=O)OC | |
| AKOS005251575 | 415.42 | C19 H17 N3 O6 S | WPOSOHXQUCWWIW-UHFFFAOYSA-N | InChI=1S/C19H17N3O6S/c1-11-3-4-12(18(24)25)9-15(11)20-16(23)10-29-17-19(26)28-21-22(17)13-5-7-14(27-2)8-6-13/h3-9H,10H2,1-2H3,(H2-,20,21,23,24,25,26) | Cc1ccc(cc1NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-])C(=O)O | |
| AKOS005251591 | 415.42 | C19 H17 N3 O6 S | NXQVAGSVWIWKJS-UHFFFAOYSA-N | InChI=1S/C19H17N3O6S/c1-25-14-5-3-13(4-6-14)22-18(19(24)28-21-22)29-11-17(23)20-12-2-7-15-16(10-12)27-9-8-26-15/h2-7,10H,8-9,11H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc4c(c3)OCCO4 | |
| AKOS005251777 | 415.42 | C19 H17 N3 O6 S | MFCCCHRRDHKZCW-UHFFFAOYSA-N | InChI=1S/C19H17N3O6S/c1-11(16(23)20-14-9-8-12(18(24)25)10-15(14)27-2)29-17-19(26)28-21-22(17)13-6-4-3-5-7-13/h3-11H,1-2H3,(H2-,20,21,23,24,25,26) | CC(C(=O)Nc1ccc(cc1OC)C(=O)O)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251817 | 415.42 | C19 H17 N3 O6 S | JSSHRCHOKAYETE-UHFFFAOYSA-N | InChI=1S/C19H17N3O6S/c1-11(17(23)20-12-3-8-15-16(9-12)27-10-26-15)29-18-19(24)28-21-22(18)13-4-6-14(25-2)7-5-13/h3-9,11H,10H2,1-2H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccc2c(c1)OCO2)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005251822 | 415.42 | C19 H17 N3 O6 S | HTWLJVYGWKKVSY-UHFFFAOYSA-N | InChI=1S/C19H17N3O6S/c1-11(16(23)20-13-5-3-12(4-6-13)18(24)25)29-17-19(26)28-21-22(17)14-7-9-15(27-2)10-8-14/h3-11H,1-2H3,(H2-,20,21,23,24,25,26) | CC(C(=O)Nc1ccc(cc1)C(=O)O)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251823 | 415.42 | C19 H17 N3 O6 S | YNJOSCFQVDWCPM-UHFFFAOYSA-N | InChI=1S/C19H17N3O6S/c1-11(16(23)20-13-5-3-4-12(10-13)18(24)25)29-17-19(26)28-21-22(17)14-6-8-15(27-2)9-7-14/h3-11H,1-2H3,(H2-,20,21,23,24,25,26) | CC(C(=O)Nc1cccc(c1)C(=O)O)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251909 | 415.42 | C19 H17 N3 O6 S | IZEKWVOVIYZOAK-UHFFFAOYSA-N | InChI=1S/C19H17N3O6S/c1-2-15(16(24)20-11-8-9-14(23)13(10-11)18(25)26)29-17-19(27)28-21-22(17)12-6-4-3-5-7-12/h3-10,15,21H,2H2,1H3,(H2,25,26,27) | CCC(C(=O)Nc1ccc(c(c1)C(=O)O)O)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252176 | 415.42 | C19 H17 N3 O6 S | UIMJSPWFFNUOJP-UHFFFAOYSA-N | InChI=1S/C19H17N3O6S/c1-27-15-11-12(18(24)25)7-8-14(15)20-16(23)9-10-29-17-19(26)28-21-22(17)13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H2-,20,21,23,24,25,26) | COc1cc(ccc1NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-])C(=O)O | |
| AKOS005252189 | 415.42 | C19 H17 N3 O6 S | OTPBGRZDVJGCOO-UHFFFAOYSA-N | InChI=1S/C19H17N3O6S/c1-27-15-8-6-14(7-9-15)22-17(19(26)28-21-22)29-11-10-16(23)20-13-4-2-12(3-5-13)18(24)25/h2-9H,10-11H2,1H3,(H2-,20,21,23,24,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)C(=O)O | |
| AKOS005252190 | 415.42 | C19 H17 N3 O6 S | ATRSGYVHDTXNRS-UHFFFAOYSA-N | InChI=1S/C19H17N3O6S/c1-27-15-7-5-14(6-8-15)22-17(19(26)28-21-22)29-10-9-16(23)20-13-4-2-3-12(11-13)18(24)25/h2-8,11H,9-10H2,1H3,(H2-,20,21,23,24,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cccc(c3)C(=O)O | |
| AKOS005252222 | 415.42 | C19 H17 N3 O6 S | IOPFOEOZEGVSIP-UHFFFAOYSA-N | InChI=1S/C19H17N3O6S/c1-25-14-5-3-13(4-6-14)22-18(19(24)28-21-22)29-9-8-17(23)20-12-2-7-15-16(10-12)27-11-26-15/h2-7,10H,8-9,11H2,1H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc4c(c3)OCO4 | |
| AKOS005251622 | 431.419 | C19 H17 N3 O7 S | QJNSJDPBNUQYJL-UHFFFAOYSA-N | InChI=1S/C19H17N3O7S/c1-27-13-6-4-12(5-7-13)22-17(19(26)29-21-22)30-10-16(23)20-14-8-3-11(18(24)25)9-15(14)28-2/h3-9H,10H2,1-2H3,(H2-,20,21,23,24,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3OC)C(=O)O | |
| AKOS005251863 | 431.419 | C19 H17 N3 O7 S | FMEXMIJXIPMMEG-UHFFFAOYSA-N | InChI=1S/C19H17N3O7S/c1-10(16(24)20-11-3-8-15(23)14(9-11)18(25)26)30-17-19(27)29-21-22(17)12-4-6-13(28-2)7-5-12/h3-10,21H,1-2H3,(H2,25,26,27) | CC(C(=O)Nc1ccc(c(c1)C(=O)O)O)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252230 | 431.419 | C19 H17 N3 O7 S | KKALHCBIMBITQJ-UHFFFAOYSA-N | InChI=1S/C19H17N3O7S/c1-28-13-5-3-12(4-6-13)22-17(19(27)29-21-22)30-9-8-16(24)20-11-2-7-15(23)14(10-11)18(25)26/h2-7,10,21H,8-9H2,1H3,(H2,25,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(c(c3)C(=O)O)O | |
| AKOS005252023 | 429.426 | C19 H17 N4 O6 S | LHFPTQVGVBAOMN-UHFFFAOYSA-M | InChI=1S/C19H18N4O6S/c1-3-16(17(24)20-12-4-6-14(7-5-12)23(26)27)30-18-19(25)29-21-22(18)13-8-10-15(28-2)11-9-13/h4,6-11,16,25H,3H2,1-2H3,(H,20,24)/p-1 | CCC(C(=O)Nc1ccc(c[c-]1)[N+](=O)[O-])Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252448 | 379.436 | C19 H17 N5 O2 S | ZVRGNSVMOWHNJS-UHFFFAOYSA-N | InChI=1S/C19H17N5O2S/c1-3-24-11-18(26-23-24)22-17(25)12-27-19-15(10-20)8-9-16(21-19)14-6-4-13(2)5-7-14/h4-9,11H,3,12H2,1-2H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)c3ccc(cc3)C)C#N | |
| AKOS005252878 | 379.436 | C19 H17 N5 O2 S | IHVUILVYHYZWRG-UHFFFAOYSA-N | InChI=1S/C19H17N5O2S/c1-13(2)24-11-18(26-23-24)22-17(25)12-27-19-15(10-20)8-9-16(21-19)14-6-4-3-5-7-14/h3-9,11,13H,12H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)c3ccccc3)C#N | |
| AKOS005250614 | 395.435 | C19 H17 N5 O3 S | RDOFKCOVAJIFQQ-UHFFFAOYSA-N | InChI=1S/C19H17N5O3S/c1-23-16(19(26)27-22-23)17(25)21-18-14(9-20)13-7-8-24(11-15(13)28-18)10-12-5-3-2-4-6-12/h2-6H,7-8,10-11H2,1H3,(H-,21,22,25,26) | C[n+]1c(c(on1)[O-])C(=O)Nc2c(c3c(s2)CN(CC3)Cc4ccccc4)C#N | |
| AKOS005252447 | 395.435 | C19 H17 N5 O3 S | PEUIHZLGNZHTGN-UHFFFAOYSA-N | InChI=1S/C19H17N5O3S/c1-3-24-11-18(27-23-24)22-17(25)12-28-19-14(10-20)6-9-16(21-19)13-4-7-15(26-2)8-5-13/h4-9,11H,3,12H2,1-2H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)c3ccc(cc3)OC)C#N | |
| AKOS005253295 | 395.435 | C19 H17 N5 O3 S | CCHHKHBGLAUKHB-UHFFFAOYSA-N | InChI=1S/C19H17N5O3S/c1-26-10-9-24-12-18(27-23-24)22-17(25)13-28-19-15(11-20)7-8-16(21-19)14-5-3-2-4-6-14/h2-8,12H,9-10,13H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)c3ccccc3)C#N | |
| AKOS005250929 | 379.369 | C19 H17 N5 O4 | WNNUGIRAJNBJKU-UHFFFAOYSA-O | InChI=1S/C19H16N5O4/c1-24-16(19(27)28-23-24)10-15(22-17(25)14-7-3-2-4-8-14)18(26)21-12-13-6-5-9-20-11-13/h2-11H,12H2,1H3,(H,21,26)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCc2cccnc2)\NC(=O)c3ccccc3 | |
| AKOS005251747 | 443.499 | C19 H17 N5 O4 S2 | SUIYDODULQXSCL-UHFFFAOYSA-N | InChI=1S/C19H17N5O4S2/c1-10-13(9-20)17(30-14(10)16(26)21-12-7-5-4-6-8-12)22-15(25)11(2)29-18-19(27)28-23-24(18)3/h4-8,11H,1-3H3,(H2-,21,22,23,25,26,27) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)C(C)Sc3c(on[n+]3C)[O-])C#N | |
| AKOS005252664 | 443.499 | C19 H17 N5 O4 S2 | CZUHFQVKARXQDL-UHFFFAOYSA-N | InChI=1S/C19H17N5O4S2/c1-11-13(10-20)17(30-15(11)16(26)21-12-6-4-3-5-7-12)22-14(25)8-9-29-18-19(27)28-23-24(18)2/h3-7H,8-9H2,1-2H3,(H2-,21,22,23,25,26,27) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)CCSc3c(on[n+]3C)[O-])C#N | |
| AKOS005250489 | 395.369 | C19 H17 N5 O5 | WBJICVKHGUOQBM-UHFFFAOYSA-N | InChI=1S/C19H17N5O5/c25-18(17-19(26)29-20-23(17)15-4-2-1-3-5-15)22-12-10-21(11-13-22)14-6-8-16(9-7-14)24(27)28/h1-9H,10-13H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)c4ccc(cc4)[N+](=O)[O-] | |
| AKOS005253169 | 443.433 | C19 H17 N5 O6 S | NSTQPUGYVVDXGE-UHFFFAOYSA-N | InChI=1S/C19H17N5O6S/c20-31(28,29)14-8-6-12(7-9-14)23-17(25)10-15(18(23)26)21-11-16-19(27)30-22-24(16)13-4-2-1-3-5-13/h1-9,15,21H,10-11H2,(H2-,20,22,27,28,29) | c1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)S(=O)(=O)N | |
| AKOS005215646 | 407.449 | C19 H17 N7 O2 S | FOPUUGJKADVNNU-UHFFFAOYSA-N | InChI=1S/C19H17N7O2S/c1-10(2)26-15(14-12(8-20)16(22)29-17(23)13(14)9-21)19(28-25-26)24-18(27)11-6-4-3-5-7-11/h3-7,10,14H,22-23H2,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)C3C(=C(SC(=C3C#N)N)N)C#N | |
| AKOS005251729 | 464.333 | C19 H18 Br N3 O4 S | MGJASEAYHGUMQY-UHFFFAOYSA-N | InChI=1S/C19H18BrN3O4S/c1-3-16(17(24)21-15-7-5-4-6-14(15)20)28-18-19(25)27-22-23(18)12-8-10-13(26-2)11-9-12/h4-11,16H,3H2,1-2H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccccc1Br)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251736 | 464.333 | C19 H18 Br N3 O4 S | OCWDSJQESNDFGF-UHFFFAOYSA-N | InChI=1S/C19H18BrN3O4S/c1-3-16(17(24)21-13-6-4-12(20)5-7-13)28-18-19(25)27-22-23(18)14-8-10-15(26-2)11-9-14/h4-11,16H,3H2,1-2H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc(cc1)Br)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251689 | 403.883 | C19 H18 Cl N3 O3 S | MAQOVCNLUVUECK-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O3S/c1-3-16(17(24)21-13-10-9-12(2)15(20)11-13)27-18-19(25)26-22-23(18)14-7-5-4-6-8-14/h4-11,16H,3H2,1-2H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc(c(c1)Cl)C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251725 | 403.883 | C19 H18 Cl N3 O3 S | RUPJWNFYQCEXIU-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O3S/c1-3-16(17(24)21-15-11-7-10-14(20)12(15)2)27-18-19(25)26-22-23(18)13-8-5-4-6-9-13/h4-11,16H,3H2,1-2H3,(H-,21,22,24,25) | CCC(C(=O)Nc1cccc(c1C)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252123 | 403.883 | C19 H18 Cl N3 O3 S | UETYTCHWAHKQBI-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O3S/c1-3-16(17(24)21-15-11-13(20)10-9-12(15)2)27-18-19(25)26-22-23(18)14-7-5-4-6-8-14/h4-11,16H,3H2,1-2H3,(H-,21,22,24,25) | CCC(C(=O)Nc1cc(ccc1C)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250270 | 387.817 | C19 H18 Cl N3 O4 | SMTCNAJKWYFZQW-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O4/c1-22(18(24)11-13-3-5-14(20)6-4-13)12-17-19(25)27-21-23(17)15-7-9-16(26-2)10-8-15/h3-10H,11-12H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)Cc3ccc(cc3)Cl | |
| AKOS005251462 | 419.882 | C19 H18 Cl N3 O4 S | SQSHDZIYKABVEU-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O4S/c1-11-9-15(16(26-3)10-14(11)20)21-17(24)12(2)28-18-19(25)27-22-23(18)13-7-5-4-6-8-13/h4-10,12H,1-3H3,(H-,21,22,24,25) | Cc1cc(c(cc1Cl)OC)NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251681 | 419.882 | C19 H18 Cl N3 O4 S | PUIDUPVZEQBHAY-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O4S/c1-3-16(17(24)21-13-6-4-5-12(20)11-13)28-18-19(25)27-22-23(18)14-7-9-15(26-2)10-8-14/h4-11,16H,3H2,1-2H3,(H-,21,22,24,25) | CCC(C(=O)Nc1cccc(c1)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251711 | 419.882 | C19 H18 Cl N3 O4 S | HGGYKGCGCUGDSW-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O4S/c1-3-16(17(24)21-13-6-4-12(20)5-7-13)28-18-19(25)27-22-23(18)14-8-10-15(26-2)11-9-14/h4-11,16H,3H2,1-2H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc(cc1)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251719 | 419.882 | C19 H18 Cl N3 O4 S | VVIZLAIRTHWOBK-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O4S/c1-3-16(17(24)21-15-7-5-4-6-14(15)20)28-18-19(25)27-22-23(18)12-8-10-13(26-2)11-9-12/h4-11,16H,3H2,1-2H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccccc1Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251788 | 419.882 | C19 H18 Cl N3 O4 S | NTHJNXUKMHOVMC-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O4S/c1-11-15(20)5-4-6-16(11)21-17(24)12(2)28-18-19(25)27-22-23(18)13-7-9-14(26-3)10-8-13/h4-10,12H,1-3H3,(H-,21,22,24,25) | Cc1c(cccc1Cl)NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251789 | 419.882 | C19 H18 Cl N3 O4 S | JKMSYQYVVAMRPV-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O4S/c1-11-4-5-13(10-16(11)20)21-17(24)12(2)28-18-19(25)27-22-23(18)14-6-8-15(26-3)9-7-14/h4-10,12H,1-3H3,(H-,21,22,24,25) | Cc1ccc(cc1Cl)NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251790 | 419.882 | C19 H18 Cl N3 O4 S | SSXTUSHOGIDRIA-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O4S/c1-11-4-5-13(20)10-16(11)21-17(24)12(2)28-18-19(25)27-22-23(18)14-6-8-15(26-3)9-7-14/h4-10,12H,1-3H3,(H-,21,22,24,25) | Cc1ccc(cc1NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-])Cl | |
| AKOS005251895 | 419.882 | C19 H18 Cl N3 O4 S | AUXMPCMJICHWJA-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O4S/c1-3-16(17(24)21-14-11-12(20)9-10-15(14)26-2)28-18-19(25)27-22-23(18)13-7-5-4-6-8-13/h4-11,16H,3H2,1-2H3,(H-,21,22,24,25) | CCC(C(=O)Nc1cc(ccc1OC)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252009 | 419.882 | C19 H18 Cl N3 O4 S | ZINXKDXARNHIDE-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O4S/c1-3-16(17(24)21-12-9-10-15(26-2)14(20)11-12)28-18-19(25)27-22-23(18)13-7-5-4-6-8-13/h4-11,16H,3H2,1-2H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc(c(c1)Cl)OC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252223 | 419.882 | C19 H18 Cl N3 O4 S | PSIIPJWMHZOBEO-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O4S/c1-12-15(20)4-3-5-16(12)21-17(24)10-11-28-18-19(25)27-22-23(18)13-6-8-14(26-2)9-7-13/h3-9H,10-11H2,1-2H3,(H-,21,22,24,25) | Cc1c(cccc1Cl)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252224 | 419.882 | C19 H18 Cl N3 O4 S | UGKAHZUTBGBVMK-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O4S/c1-12-3-4-13(11-16(12)20)21-17(24)9-10-28-18-19(25)27-22-23(18)14-5-7-15(26-2)8-6-14/h3-8,11H,9-10H2,1-2H3,(H-,21,22,24,25) | Cc1ccc(cc1Cl)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252231 | 419.882 | C19 H18 Cl N3 O4 S | GQQNCWGXRHDXMI-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O4S/c1-12-3-4-13(20)11-16(12)21-17(24)9-10-28-18-19(25)27-22-23(18)14-5-7-15(26-2)8-6-14/h3-8,11H,9-10H2,1-2H3,(H-,21,22,24,25) | Cc1ccc(cc1NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-])Cl | |
| AKOS005252245 | 419.882 | C19 H18 Cl N3 O4 S | UZIVLADSFBZCEX-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O4S/c1-12-10-15(16(26-2)11-14(12)20)21-17(24)8-9-28-18-19(25)27-22-23(18)13-6-4-3-5-7-13/h3-7,10-11H,8-9H2,1-2H3,(H-,21,22,24,25) | Cc1cc(c(cc1Cl)OC)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251452 | 435.881 | C19 H18 Cl N3 O5 S | ODNPUBJZSONATJ-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O5S/c1-11(17(24)21-14-9-13(20)15(26-2)10-16(14)27-3)29-18-19(25)28-22-23(18)12-7-5-4-6-8-12/h4-11H,1-3H3,(H-,21,22,24,25) | CC(C(=O)Nc1cc(c(cc1OC)OC)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251649 | 435.881 | C19 H18 Cl N3 O5 S | LTOGGIUTCREPGG-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O5S/c1-11-8-15(16(27-3)9-14(11)20)21-17(24)10-29-18-19(25)28-22-23(18)12-4-6-13(26-2)7-5-12/h4-9H,10H2,1-3H3,(H-,21,22,24,25) | Cc1cc(c(cc1Cl)OC)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251830 | 435.881 | C19 H18 Cl N3 O5 S | ZIJKRUMSIWBISX-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O5S/c1-11(17(24)21-12-4-9-16(27-3)15(20)10-12)29-18-19(25)28-22-23(18)13-5-7-14(26-2)8-6-13/h4-11H,1-3H3,(H-,21,22,24,25) | CC(C(=O)Nc1ccc(c(c1)Cl)OC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251831 | 435.881 | C19 H18 Cl N3 O5 S | SKKKPAIUTYMXFG-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O5S/c1-11(17(24)21-15-10-12(20)4-9-16(15)27-3)29-18-19(25)28-22-23(18)13-5-7-14(26-2)8-6-13/h4-11H,1-3H3,(H-,21,22,24,25) | CC(C(=O)Nc1cc(ccc1OC)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252213 | 435.881 | C19 H18 Cl N3 O5 S | RJBVBMHLBWZUKX-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O5S/c1-26-14-6-4-13(5-7-14)23-18(19(25)28-22-23)29-10-9-17(24)21-12-3-8-16(27-2)15(20)11-12/h3-8,11H,9-10H2,1-2H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(c(c3)Cl)OC | |
| AKOS005252214 | 435.881 | C19 H18 Cl N3 O5 S | SBAOMAYCZXSIKX-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O5S/c1-26-14-6-4-13(5-7-14)23-18(19(25)28-22-23)29-10-9-17(24)21-15-11-12(20)3-8-16(15)27-2/h3-8,11H,9-10H2,1-2H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cc(ccc3OC)Cl | |
| AKOS005252261 | 435.881 | C19 H18 Cl N3 O5 S | BSGNJKGLAXHVMO-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O5S/c1-26-15-11-16(27-2)14(10-13(15)20)21-17(24)8-9-29-18-19(25)28-22-23(18)12-6-4-3-5-7-12/h3-7,10-11H,8-9H2,1-2H3,(H-,21,22,24,25) | COc1cc(c(cc1NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-])Cl)OC | |
| AKOS005251635 | 451.881 | C19 H18 Cl N3 O6 S | CYLAORQCVVDMKY-UHFFFAOYSA-N | InChI=1S/C19H18ClN3O6S/c1-26-12-6-4-11(5-7-12)23-18(19(25)29-22-23)30-10-17(24)21-14-8-13(20)15(27-2)9-16(14)28-3/h4-9H,10H2,1-3H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cc(c(cc3OC)OC)Cl | |
| AKOS005252080 | 403.427 | C19 H18 F N3 O4 S | PAVCHCFYCSKTLW-UHFFFAOYSA-N | InChI=1S/C19H18FN3O4S/c1-3-16(17(24)21-15-7-5-4-6-14(15)20)28-18-19(25)27-22-23(18)12-8-10-13(26-2)11-9-12/h4-11,16H,3H2,1-2H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccccc1F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252095 | 403.427 | C19 H18 F N3 O4 S | LGWVWNJIXIKBMC-UHFFFAOYSA-N | InChI=1S/C19H18FN3O4S/c1-3-16(17(24)21-13-6-4-12(20)5-7-13)28-18-19(25)27-22-23(18)14-8-10-15(26-2)11-9-14/h4-11,16H,3H2,1-2H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc(cc1)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005253493 | 485.437 | C19 H18 F3 N5 O5 S | OSDREXKQFBBTQN-UHFFFAOYSA-N | InChI=1S/C19H18F3N5O5S/c1-25-14(17(30)32-24-25)9-26-13(16(29)27(18(26)33)11-4-5-11)8-15(28)23-10-2-6-12(7-3-10)31-19(20,21)22/h2-3,6-7,11,13H,4-5,8-9H2,1H3,(H-,23,24,28,30) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C3CC3)CC(=O)Nc4ccc(cc4)OC(F)(F)F | |
| AKOS005252104 | 511.333 | C19 H18 I N3 O4 S | BKHBWHFSXBBYBY-UHFFFAOYSA-N | InChI=1S/C19H18IN3O4S/c1-3-16(17(24)21-13-6-4-12(20)5-7-13)28-18-19(25)27-22-23(18)14-8-10-15(26-2)11-9-14/h4-11,16H,3H2,1-2H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc(cc1)I)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005214197 | 334.372 | C19 H18 N4 O2 | IGRSJIBJQJGPFM-UHFFFAOYSA-N | InChI=1S/C19H18N4O2/c24-19-18(23(22-25-19)15-6-2-1-3-7-15)13-20-11-10-14-12-21-17-9-5-4-8-16(14)17/h1-9,12,20-21H,10-11,13H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3c[nH]c4c3cccc4 | |
| AKOS005219779 | 366.437 | C19 H18 N4 O2 S | FIFKZCMMHMUTSK-UHFFFAOYSA-N | InChI=1S/C19H18N4O2S/c24-18-17(23(21-25-18)16-9-5-2-6-10-16)13-22(15-11-12-15)19(26)20-14-7-3-1-4-8-14/h1-10,15H,11-13H2,(H-,20,21,24,26) | c1ccc(cc1)NC(=S)N(Cc2c(on[n+]2c3ccccc3)[O-])C4CC4 | |
| AKOS005250478 | 350.371 | C19 H18 N4 O3 | HUTSEGLEBVRMOD-UHFFFAOYSA-N | InChI=1S/C19H18N4O3/c24-18(17-19(25)26-20-23(17)16-9-5-2-6-10-16)22-13-11-21(12-14-22)15-7-3-1-4-8-15/h1-10H,11-14H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)c4ccccc4 | |
| AKOS005251886 | 398.436 | C19 H18 N4 O4 S | SKIMYNJLNFTBJR-UHFFFAOYSA-N | InChI=1S/C19H18N4O4S/c1-12(17(25)21-15-10-8-14(9-11-15)20-13(2)24)28-18-19(26)27-22-23(18)16-6-4-3-5-7-16/h3-12,22,26H,1-2H3 | CC(C(=O)Nc1ccc(cc1)NC(=O)C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251900 | 398.436 | C19 H18 N4 O4 S | WYBITLJXINGGAE-UHFFFAOYSA-N | InChI=1S/C19H18N4O4S/c1-2-15(17(25)21-13-10-8-12(9-11-13)16(20)24)28-18-19(26)27-22-23(18)14-6-4-3-5-7-14/h3-11,15H,2H2,1H3,(H3-,20,21,22,24,25,26) | CCC(C(=O)Nc1ccc(cc1)C(=O)N)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251903 | 398.436 | C19 H18 N4 O4 S | MYHQVYCHVABGMH-UHFFFAOYSA-N | InChI=1S/C19H18N4O4S/c1-2-15(17(25)21-14-11-7-6-10-13(14)16(20)24)28-18-19(26)27-22-23(18)12-8-4-3-5-9-12/h3-11,15H,2H2,1H3,(H3-,20,21,22,24,25,26) | CCC(C(=O)Nc1ccccc1C(=O)N)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252151 | 398.436 | C19 H18 N4 O4 S | BVGPERXMLRMNPY-UHFFFAOYSA-N | InChI=1S/C19H18N4O4S/c1-13(24)20-14-7-9-15(10-8-14)21-17(25)11-12-28-18-19(26)27-22-23(18)16-5-3-2-4-6-16/h2-10,22,26H,11-12H2,1H3 | CC(=O)Nc1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251555 | 414.435 | C19 H18 N4 O5 S | SXQCDYDBRRARRB-UHFFFAOYSA-N | InChI=1S/C19H18N4O5S/c1-12(24)20-13-3-5-14(6-4-13)21-17(25)11-29-18-19(26)28-22-23(18)15-7-9-16(27-2)10-8-15/h3-10,22,26H,11H2,1-2H3 | CC(=O)Nc1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251854 | 414.435 | C19 H18 N4 O5 S | ZVACYYKHTBHNSC-UHFFFAOYSA-N | InChI=1S/C19H18N4O5S/c1-11(17(25)21-13-5-3-12(4-6-13)16(20)24)29-18-19(26)28-22-23(18)14-7-9-15(27-2)10-8-14/h3-11H,1-2H3,(H3-,20,21,22,24,25,26) | CC(C(=O)Nc1ccc(cc1)C(=O)N)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251855 | 414.435 | C19 H18 N4 O5 S | HOFWBTNJUIXKJH-UHFFFAOYSA-N | InChI=1S/C19H18N4O5S/c1-11(17(25)21-15-6-4-3-5-14(15)16(20)24)29-18-19(26)28-22-23(18)12-7-9-13(27-2)10-8-12/h3-11H,1-2H3,(H3-,20,21,22,24,25,26) | CC(C(=O)Nc1ccccc1C(=O)N)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252065 | 414.435 | C19 H18 N4 O5 S | XOUOLWQYZFMBPC-UHFFFAOYSA-N | InChI=1S/C19H18N4O5S/c1-3-16(17(24)20-15-10-9-14(23(26)27)11-12(15)2)29-18-19(25)28-21-22(18)13-7-5-4-6-8-13/h4-11,16H,3H2,1-2H3,(H-,20,21,24,25) | CCC(C(=O)Nc1ccc(cc1C)[N+](=O)[O-])Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252090 | 414.435 | C19 H18 N4 O5 S | VDNHIAVTVHTLBA-UHFFFAOYSA-N | InChI=1S/C19H18N4O5S/c1-3-16(17(24)20-15-11-14(23(26)27)10-9-12(15)2)29-18-19(25)28-21-22(18)13-7-5-4-6-8-13/h4-11,16H,3H2,1-2H3,(H-,20,21,24,25) | CCC(C(=O)Nc1cc(ccc1C)[N+](=O)[O-])Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252205 | 414.435 | C19 H18 N4 O5 S | QWCLLDAHAJAIRC-UHFFFAOYSA-N | InChI=1S/C19H18N4O5S/c1-27-15-8-6-14(7-9-15)23-18(19(26)28-22-23)29-11-10-16(24)21-13-4-2-12(3-5-13)17(20)25/h2-9H,10-11H2,1H3,(H3-,20,21,22,24,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)C(=O)N | |
| AKOS005252206 | 414.435 | C19 H18 N4 O5 S | DIEBTWCAKVJFAO-UHFFFAOYSA-N | InChI=1S/C19H18N4O5S/c1-27-13-8-6-12(7-9-13)23-18(19(26)28-22-23)29-11-10-16(24)21-15-5-3-2-4-14(15)17(20)25/h2-9H,10-11H2,1H3,(H3-,20,21,22,24,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccccc3C(=O)N | |
| AKOS005219716 | 398.369 | C19 H18 N4 O6 | NPGFZFHOOKOWHN-UHFFFAOYSA-N | InChI=1S/C19H18N4O6/c1-4-27-18(24)14-10(2)28-17(21)13(9-20)15(14)16-19(25)29-22-23(16)11-5-7-12(26-3)8-6-11/h5-8,15H,4,21H2,1-3H3 | CCOC(=O)C1=C(OC(=C(C1c2c(on[n+]2c3ccc(cc3)OC)[O-])C#N)N)C | |
| AKOS005250583 | 398.369 | C19 H18 N4 O6 | PKKQODNAYMRCHV-UHFFFAOYSA-N | InChI=1S/C19H18N4O6/c1-27-14-6-4-13(5-7-14)23-16(19(26)29-20-23)18(25)22-10-8-21(9-11-22)17(24)15-3-2-12-28-15/h2-7,12H,8-11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)C(=O)c4ccco4 | |
| AKOS005250553 | 430.434 | C19 H18 N4 O6 S | NCQFZPKWYZMWAI-UHFFFAOYSA-N | InChI=1S/C19H18N4O6S/c1-4-28-18(26)12-10(2)14(16(25)20-11-8-6-5-7-9-11)30-17(12)21-15(24)13-19(27)29-22-23(13)3/h5-9H,4H2,1-3H3,(H2-,20,21,22,24,25,26,27) | CCOC(=O)c1c(c(sc1NC(=O)c2c(on[n+]2C)[O-])C(=O)Nc3ccccc3)C | |
| AKOS005251860 | 430.434 | C19 H18 N4 O6 S | ZJDUWWRJNYZEEH-UHFFFAOYSA-N | InChI=1S/C19H18N4O6S/c1-11-10-14(23(26)27)6-9-16(11)20-17(24)12(2)30-18-19(25)29-21-22(18)13-4-7-15(28-3)8-5-13/h4-10,12H,1-3H3,(H-,20,21,24,25) | Cc1cc(ccc1NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-])[N+](=O)[O-] | |
| AKOS005251861 | 430.434 | C19 H18 N4 O6 S | BEQNSUXPOWNVGM-UHFFFAOYSA-N | InChI=1S/C19H18N4O6S/c1-11-4-5-14(23(26)27)10-16(11)20-17(24)12(2)30-18-19(25)29-21-22(18)13-6-8-15(28-3)9-7-13/h4-10,12H,1-3H3,(H-,20,21,24,25) | Cc1ccc(cc1NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-])[N+](=O)[O-] | |
| AKOS005252219 | 430.434 | C19 H18 N4 O6 S | RKZQASPKTCAQPY-UHFFFAOYSA-N | InChI=1S/C19H18N4O6S/c1-12-11-14(23(26)27)5-8-16(12)20-17(24)9-10-30-18-19(25)29-21-22(18)13-3-6-15(28-2)7-4-13/h3-8,11H,9-10H2,1-2H3,(H-,20,21,24,25) | Cc1cc(ccc1NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-])[N+](=O)[O-] | |
| AKOS005252220 | 430.434 | C19 H18 N4 O6 S | RFTAFDYVSHOBPA-UHFFFAOYSA-N | InChI=1S/C19H18N4O6S/c1-12-3-4-14(23(26)27)11-16(12)20-17(24)9-10-30-18-19(25)29-21-22(18)13-5-7-15(28-2)8-6-13/h3-8,11H,9-10H2,1-2H3,(H-,20,21,24,25) | Cc1ccc(cc1NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-])[N+](=O)[O-] | |
| AKOS005251586 | 462.499 | C19 H18 N4 O6 S2 | DHFVBHQYLCKKLB-UHFFFAOYSA-N | InChI=1S/C19H18N4O6S2/c1-10-13(18(26)28-3)16(21-12(24)9-30-17-19(27)29-22-23(17)2)31-14(10)15(25)20-11-7-5-4-6-8-11/h4-8H,9H2,1-3H3,(H2-,20,21,22,24,25,26,27) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)CSc3c(on[n+]3C)[O-])C(=O)OC | |
| AKOS005252723 | 394.45 | C19 H18 N6 O2 S | AYJUUGNQWJPTLZ-UHFFFAOYSA-N | InChI=1S/C19H18N6O2S/c1-13-4-6-14(7-5-13)16-9-8-15(10-20)19(21-16)28-12-17(26)22-18-11-25(23-27-18)24(2)3/h4-9,11H,12H2,1-3H3 | Cc1ccc(cc1)c2ccc(c(n2)SCC(=O)[N-]c3c[n+](no3)N(C)C)C#N | |
| AKOS005252716 | 410.45 | C19 H18 N6 O3 S | VPFKPTLLOVFYPP-UHFFFAOYSA-N | InChI=1S/C19H18N6O3S/c1-24(2)25-11-18(28-23-25)22-17(26)12-29-19-14(10-20)6-9-16(21-19)13-4-7-15(27-3)8-5-13/h4-9,11H,12H2,1-3H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)c3ccc(cc3)OC)C#N | |
| AKOS005215575 | 432.251 | C19 H19 Br N3 O2 P | NEKMFDSMQDKYIK-UHFFFAOYSA-N | InChI=1S/C19H19BrN3O2P/c1-3-23-19(18(25-22-23)21-17(24)14(2)20)26(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-14H,3H2,1-2H3 | CC[n+]1c(c(on1)[N-]C(=O)C(C)Br)P(c2ccccc2)c3ccccc3 | |
| AKOS005215548 | 353.438 | C19 H19 N3 O2 S | DVZWSDDBNFLTCZ-UHFFFAOYSA-N | InChI=1S/C19H19N3O2S/c1-14(2)22-19(25-13-15-9-5-3-6-10-15)18(24-21-22)20-17(23)16-11-7-4-8-12-16/h3-12,14H,13H2,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)SCc3ccccc3 | |
| AKOS005251152 | 369.437 | C19 H19 N3 O3 S | AIJGEKRGFPGWCK-UHFFFAOYSA-N | InChI=1S/C19H19N3O3S/c1-13(2)14-8-10-15(11-9-14)20-17(23)12-26-18-19(24)25-21-22(18)16-6-4-3-5-7-16/h3-11,13H,12H2,1-2H3,(H-,20,21,23,24) | CC(C)c1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251207 | 369.437 | C19 H19 N3 O3 S | OESRVCRMMGENEQ-UHFFFAOYSA-N | InChI=1S/C19H19N3O3S/c1-3-14-9-7-8-13(2)17(14)20-16(23)12-26-18-19(24)25-21-22(18)15-10-5-4-6-11-15/h4-11H,3,12H2,1-2H3,(H-,20,21,23,24) | CCc1cccc(c1NC(=O)CSc2c(on[n+]2c3ccccc3)[O-])C | |
| AKOS005251411 | 369.437 | C19 H19 N3 O3 S | VNZIEEIULBLODW-UHFFFAOYSA-N | InChI=1S/C19H19N3O3S/c1-12-8-7-11-16(13(12)2)20-17(23)14(3)26-18-19(24)25-21-22(18)15-9-5-4-6-10-15/h4-11,14H,1-3H3,(H-,20,21,23,24) | Cc1cccc(c1C)NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251412 | 369.437 | C19 H19 N3 O3 S | UXVGHCUPSHJHAI-UHFFFAOYSA-N | InChI=1S/C19H19N3O3S/c1-12-9-10-16(13(2)11-12)20-17(23)14(3)26-18-19(24)25-21-22(18)15-7-5-4-6-8-15/h4-11,14H,1-3H3,(H-,20,21,23,24) | Cc1ccc(c(c1)C)NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251441 | 369.437 | C19 H19 N3 O3 S | OIWWZLWZUJCVRQ-UHFFFAOYSA-N | InChI=1S/C19H19N3O3S/c1-12-9-10-13(2)16(11-12)20-17(23)14(3)26-18-19(24)25-21-22(18)15-7-5-4-6-8-15/h4-11,14H,1-3H3,(H-,20,21,23,24) | Cc1ccc(c(c1)NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-])C | |
| AKOS005251442 | 369.437 | C19 H19 N3 O3 S | QDCIPPLIRHUJDE-UHFFFAOYSA-N | InChI=1S/C19H19N3O3S/c1-12-9-10-15(11-13(12)2)20-17(23)14(3)26-18-19(24)25-21-22(18)16-7-5-4-6-8-16/h4-11,14H,1-3H3,(H-,20,21,23,24) | Cc1ccc(cc1C)NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251471 | 369.437 | C19 H19 N3 O3 S | CEGOIMGQORNIDJ-UHFFFAOYSA-N | InChI=1S/C19H19N3O3S/c1-12-9-13(2)11-15(10-12)20-17(23)14(3)26-18-19(24)25-21-22(18)16-7-5-4-6-8-16/h4-11,14H,1-3H3,(H-,20,21,23,24) | Cc1cc(cc(c1)NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-])C | |
| AKOS005251867 | 369.437 | C19 H19 N3 O3 S | NJEGGZXYIXWKNU-UHFFFAOYSA-N | InChI=1S/C19H19N3O3S/c1-12-8-7-9-13(2)16(12)20-17(23)14(3)26-18-19(24)25-21-22(18)15-10-5-4-6-11-15/h4-11,14H,1-3H3,(H-,20,21,23,24) | Cc1cccc(c1NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-])C | |
| AKOS005252025 | 369.437 | C19 H19 N3 O3 S | XCBZNAPKFHRZNQ-UHFFFAOYSA-N | InChI=1S/C19H19N3O3S/c1-3-16(17(23)20-15-12-8-7-9-13(15)2)26-18-19(24)25-21-22(18)14-10-5-4-6-11-14/h4-12,16H,3H2,1-2H3,(H-,20,21,23,24) | CCC(C(=O)Nc1ccccc1C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252028 | 369.437 | C19 H19 N3 O3 S | RMRQFYZYXUIPJN-UHFFFAOYSA-N | InChI=1S/C19H19N3O3S/c1-3-16(17(23)20-14-9-7-8-13(2)12-14)26-18-19(24)25-21-22(18)15-10-5-4-6-11-15/h4-12,16H,3H2,1-2H3,(H-,20,21,23,24) | CCC(C(=O)Nc1cccc(c1)C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252031 | 369.437 | C19 H19 N3 O3 S | JOYAYPLCPCSFDH-UHFFFAOYSA-N | InChI=1S/C19H19N3O3S/c1-3-16(17(23)20-14-11-9-13(2)10-12-14)26-18-19(24)25-21-22(18)15-7-5-4-6-8-15/h4-12,16H,3H2,1-2H3,(H-,20,21,23,24) | CCC(C(=O)Nc1ccc(cc1)C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252255 | 369.437 | C19 H19 N3 O3 S | JFMABZSKOYAHQM-UHFFFAOYSA-N | InChI=1S/C19H19N3O3S/c1-13-7-6-8-14(2)17(13)20-16(23)11-12-26-18-19(24)25-21-22(18)15-9-4-3-5-10-15/h3-10H,11-12H2,1-2H3,(H-,20,21,23,24) | Cc1cccc(c1NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-])C | |
| AKOS005252335 | 369.437 | C19 H19 N3 O3 S | NOZNEEQGYZTFFG-UHFFFAOYSA-N | InChI=1S/C19H19N3O3S/c1-13-10-14(2)12-15(11-13)20-17(23)8-9-26-18-19(24)25-21-22(18)16-6-4-3-5-7-16/h3-7,10-12H,8-9H2,1-2H3,(H-,20,21,23,24) | Cc1cc(cc(c1)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-])C | |
| AKOS005252346 | 369.437 | C19 H19 N3 O3 S | VMCAONKOOAVECR-UHFFFAOYSA-N | InChI=1S/C19H19N3O3S/c1-13-7-6-10-16(14(13)2)20-17(23)11-12-26-18-19(24)25-21-22(18)15-8-4-3-5-9-15/h3-10H,11-12H2,1-2H3,(H-,20,21,23,24) | Cc1cccc(c1C)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252347 | 369.437 | C19 H19 N3 O3 S | BTJZUWWMVKXIAB-UHFFFAOYSA-N | InChI=1S/C19H19N3O3S/c1-13-8-9-16(14(2)12-13)20-17(23)10-11-26-18-19(24)25-21-22(18)15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3,(H-,20,21,23,24) | Cc1ccc(c(c1)C)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252376 | 369.437 | C19 H19 N3 O3 S | KOJCLVVZTKKXOP-UHFFFAOYSA-N | InChI=1S/C19H19N3O3S/c1-13-8-9-14(2)16(12-13)20-17(23)10-11-26-18-19(24)25-21-22(18)15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3,(H-,20,21,23,24) | Cc1ccc(c(c1)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-])C | |
| AKOS005252377 | 369.437 | C19 H19 N3 O3 S | CWEVEZFUOVFOFP-UHFFFAOYSA-N | InChI=1S/C19H19N3O3S/c1-13-8-9-15(12-14(13)2)20-17(23)10-11-26-18-19(24)25-21-22(18)16-6-4-3-5-7-16/h3-9,12H,10-11H2,1-2H3,(H-,20,21,23,24) | Cc1ccc(cc1C)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250134 | 353.372 | C19 H19 N3 O4 | CTDUDFAGGTXSPR-UHFFFAOYSA-N | InChI=1S/C19H19N3O4/c1-4-13-7-5-6-12(2)16(13)20-18(23)17-19(24)26-21-22(17)14-8-10-15(25-3)11-9-14/h5-11H,4H2,1-3H3,(H-,20,21,23,24) | CCc1cccc(c1NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005250235 | 353.372 | C19 H19 N3 O4 | FYROJHSYNZPFCC-UHFFFAOYSA-N | InChI=1S/C19H19N3O4/c1-12(2)13-4-6-14(7-5-13)20-18(23)17-19(24)26-21-22(17)15-8-10-16(25-3)11-9-15/h4-12H,1-3H3,(H-,20,21,23,24) | CC(C)c1ccc(cc1)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250302 | 353.372 | C19 H19 N3 O4 | YTDGVFQTNVZLIN-UHFFFAOYSA-N | InChI=1S/C19H19N3O4/c1-21(18(23)12-14-6-4-3-5-7-14)13-17-19(24)26-20-22(17)15-8-10-16(25-2)11-9-15/h3-11H,12-13H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)Cc3ccccc3 | |
| AKOS005250310 | 353.372 | C19 H19 N3 O4 | SSCFNXFSUWSBNO-UHFFFAOYSA-N | InChI=1S/C19H19N3O4/c1-13-6-4-5-7-16(13)18(23)21(2)12-17-19(24)26-20-22(17)14-8-10-15(25-3)11-9-14/h4-11H,12H2,1-3H3 | Cc1ccccc1C(=O)N(C)Cc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250311 | 353.372 | C19 H19 N3 O4 | RJZOWCDNLYRCDV-UHFFFAOYSA-N | InChI=1S/C19H19N3O4/c1-13-5-4-6-14(11-13)18(23)21(2)12-17-19(24)26-20-22(17)15-7-9-16(25-3)10-8-15/h4-11H,12H2,1-3H3 | Cc1cccc(c1)C(=O)N(C)Cc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250318 | 353.372 | C19 H19 N3 O4 | WNHRYDJGPHFJMW-UHFFFAOYSA-N | InChI=1S/C19H19N3O4/c1-13-4-6-14(7-5-13)18(23)21(2)12-17-19(24)26-20-22(17)15-8-10-16(25-3)11-9-15/h4-11H,12H2,1-3H3 | Cc1ccc(cc1)C(=O)N(C)Cc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251534 | 385.437 | C19 H19 N3 O4 S | NVJVLVZDYKIZTJ-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-12-5-4-6-13(2)17(12)20-16(23)11-27-18-19(24)26-21-22(18)14-7-9-15(25-3)10-8-14/h4-10H,11H2,1-3H3,(H-,20,21,23,24) | Cc1cccc(c1NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005251632 | 385.437 | C19 H19 N3 O4 S | HUZXPTWGNNZLJF-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-12-5-4-6-16(13(12)2)20-17(23)11-27-18-19(24)26-21-22(18)14-7-9-15(25-3)10-8-14/h4-10H,11H2,1-3H3,(H-,20,21,23,24) | Cc1cccc(c1C)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251639 | 385.437 | C19 H19 N3 O4 S | DSCLJUAJKMSDAU-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-12-4-9-16(13(2)10-12)20-17(23)11-27-18-19(24)26-21-22(18)14-5-7-15(25-3)8-6-14/h4-10H,11H2,1-3H3,(H-,20,21,23,24) | Cc1ccc(c(c1)C)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251640 | 385.437 | C19 H19 N3 O4 S | MBQFTWIGSWXQLU-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-12-4-5-13(2)16(10-12)20-17(23)11-27-18-19(24)26-21-22(18)14-6-8-15(25-3)9-7-14/h4-10H,11H2,1-3H3,(H-,20,21,23,24) | Cc1ccc(c(c1)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005251647 | 385.437 | C19 H19 N3 O4 S | OTIYPDFZRWXPCG-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-12-4-5-14(10-13(12)2)20-17(23)11-27-18-19(24)26-21-22(18)15-6-8-16(25-3)9-7-15/h4-10H,11H2,1-3H3,(H-,20,21,23,24) | Cc1ccc(cc1C)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251648 | 385.437 | C19 H19 N3 O4 S | UJCDYLZYWDTTAS-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-12-8-13(2)10-14(9-12)20-17(23)11-27-18-19(24)26-21-22(18)15-4-6-16(25-3)7-5-15/h4-10H,11H2,1-3H3,(H-,20,21,23,24) | Cc1cc(cc(c1)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005251694 | 385.437 | C19 H19 N3 O4 S | VVLHNKGHNJPHAK-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-3-16(17(23)20-13-7-5-4-6-8-13)27-18-19(24)26-21-22(18)14-9-11-15(25-2)12-10-14/h4-12,16H,3H2,1-2H3,(H-,20,21,23,24) | CCC(C(=O)Nc1ccccc1)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251834 | 385.437 | C19 H19 N3 O4 S | ZFDIRMMUBNTWKH-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-12-6-4-5-7-16(12)20-17(23)13(2)27-18-19(24)26-21-22(18)14-8-10-15(25-3)11-9-14/h4-11,13H,1-3H3,(H-,20,21,23,24) | Cc1ccccc1NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251835 | 385.437 | C19 H19 N3 O4 S | YTIRITJMIZEPLC-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-12-5-4-6-14(11-12)20-17(23)13(2)27-18-19(24)26-21-22(18)15-7-9-16(25-3)10-8-15/h4-11,13H,1-3H3,(H-,20,21,23,24) | Cc1cccc(c1)NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251842 | 385.437 | C19 H19 N3 O4 S | SAWHPBNZVLSRIZ-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-12-4-6-14(7-5-12)20-17(23)13(2)27-18-19(24)26-21-22(18)15-8-10-16(25-3)11-9-15/h4-11,13H,1-3H3,(H-,20,21,23,24) | Cc1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251876 | 385.437 | C19 H19 N3 O4 S | WWQUESGAJPYWJN-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-3-25-16-12-8-7-11-15(16)20-17(23)13(2)27-18-19(24)26-21-22(18)14-9-5-4-6-10-14/h4-13H,3H2,1-2H3,(H-,20,21,23,24) | CCOc1ccccc1NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251877 | 385.437 | C19 H19 N3 O4 S | GXVIPNZRULSPFG-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-3-25-16-11-9-14(10-12-16)20-17(23)13(2)27-18-19(24)26-21-22(18)15-7-5-4-6-8-15/h4-13H,3H2,1-2H3,(H-,20,21,23,24) | CCOc1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252055 | 385.437 | C19 H19 N3 O4 S | XEKVGOPAJBXITN-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-3-16(17(23)20-13-9-11-15(25-2)12-10-13)27-18-19(24)26-21-22(18)14-7-5-4-6-8-14/h4-12,16H,3H2,1-2H3,(H-,20,21,23,24) | CCC(C(=O)Nc1ccc(cc1)OC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252101 | 385.437 | C19 H19 N3 O4 S | KCFLYZXKBXZOAL-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-3-16(17(23)20-14-11-7-8-12-15(14)25-2)27-18-19(24)26-21-22(18)13-9-5-4-6-10-13/h4-12,16H,3H2,1-2H3,(H-,20,21,23,24) | CCC(C(=O)Nc1ccccc1OC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252106 | 385.437 | C19 H19 N3 O4 S | VLIWLOZQGSUNRZ-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-3-16(27-18-19(24)26-21-22(18)2)17(23)20-13-9-11-15(12-10-13)25-14-7-5-4-6-8-14/h4-12,16H,3H2,1-2H3,(H-,20,21,23,24) | CCC(C(=O)Nc1ccc(cc1)Oc2ccccc2)Sc3c(on[n+]3C)[O-] | |
| AKOS005252110 | 385.437 | C19 H19 N3 O4 S | GCEQLTLTFVMDCI-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-3-16(17(23)20-13-8-7-11-15(12-13)25-2)27-18-19(24)26-21-22(18)14-9-5-4-6-10-14/h4-12,16H,3H2,1-2H3,(H-,20,21,23,24) | CCC(C(=O)Nc1cccc(c1)OC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252145 | 385.437 | C19 H19 N3 O4 S | LIDCTIFTFZWPFY-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-2-25-16-11-7-6-10-15(16)20-17(23)12-13-27-18-19(24)26-21-22(18)14-8-4-3-5-9-14/h3-11H,2,12-13H2,1H3,(H-,20,21,23,24) | CCOc1ccccc1NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252146 | 385.437 | C19 H19 N3 O4 S | PYSQLVPDYWHIEE-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-2-25-16-10-8-14(9-11-16)20-17(23)12-13-27-18-19(24)26-21-22(18)15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H-,20,21,23,24) | CCOc1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252201 | 385.437 | C19 H19 N3 O4 S | KLJOMUSNWRESKY-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-13-5-3-4-6-16(13)20-17(23)11-12-27-18-19(24)26-21-22(18)14-7-9-15(25-2)10-8-14/h3-10H,11-12H2,1-2H3,(H-,20,21,23,24) | Cc1ccccc1NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252202 | 385.437 | C19 H19 N3 O4 S | NVCKHLLBUYKRAJ-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-13-4-3-5-14(12-13)20-17(23)10-11-27-18-19(24)26-21-22(18)15-6-8-16(25-2)9-7-15/h3-9,12H,10-11H2,1-2H3,(H-,20,21,23,24) | Cc1cccc(c1)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252209 | 385.437 | C19 H19 N3 O4 S | PVDHAHLJOFZLEC-UHFFFAOYSA-N | InChI=1S/C19H19N3O4S/c1-13-3-5-14(6-4-13)20-17(23)11-12-27-18-19(24)26-21-22(18)15-7-9-16(25-2)10-8-15/h3-10H,11-12H2,1-2H3,(H-,20,21,23,24) | Cc1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250261 | 369.371 | C19 H19 N3 O5 | NLBPYCFAISOUED-UHFFFAOYSA-N | InChI=1S/C19H19N3O5/c1-21(18(23)17-15(25-2)10-7-11-16(17)26-3)12-14-19(24)27-20-22(14)13-8-5-4-6-9-13/h4-11H,12H2,1-3H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)c3c(cccc3OC)OC | |
| AKOS005250273 | 369.371 | C19 H19 N3 O5 | JDZDOFTYMBSLHU-UHFFFAOYSA-N | InChI=1S/C19H19N3O5/c1-21(18(23)13-5-4-6-16(11-13)26-3)12-17-19(24)27-20-22(17)14-7-9-15(25-2)10-8-14/h4-11H,12H2,1-3H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)c3cccc(c3)OC | |
| AKOS005250274 | 369.371 | C19 H19 N3 O5 | YPMUXSPKZVVRFG-UHFFFAOYSA-N | InChI=1S/C19H19N3O5/c1-21(18(23)13-4-8-15(25-2)9-5-13)12-17-19(24)27-20-22(17)14-6-10-16(26-3)11-7-14/h4-11H,12H2,1-3H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)c3ccc(cc3)OC | |
| AKOS005250295 | 369.371 | C19 H19 N3 O5 | DZXBKFWCRPRKGH-UHFFFAOYSA-N | InChI=1S/C19H19N3O5/c1-21(18(23)13-26-16-6-4-3-5-7-16)12-17-19(24)27-20-22(17)14-8-10-15(25-2)11-9-14/h3-11H,12-13H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)COc3ccccc3 | |
| AKOS005250358 | 369.371 | C19 H19 N3 O5 | QRRKGLTUSYVUSL-UHFFFAOYSA-N | InChI=1S/C19H19N3O5/c1-21(18(23)13-9-10-16(25-2)17(11-13)26-3)12-15-19(24)27-20-22(15)14-7-5-4-6-8-14/h4-11H,12H2,1-3H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)c3ccc(c(c3)OC)OC | |
| AKOS005250632 | 369.371 | C19 H19 N3 O5 | MHIZBTZPPCGTIX-UHFFFAOYSA-N | InChI=1S/C19H19N3O5/c1-25-15-9-7-14(8-10-15)22-17(19(24)27-21-22)18(23)20-12-11-13-5-3-4-6-16(13)26-2/h3-10H,11-12H2,1-2H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCCc3ccccc3OC | |
| AKOS005250653 | 369.371 | C19 H19 N3 O5 | RSAQKONEGBKLLI-UHFFFAOYSA-N | InChI=1S/C19H19N3O5/c1-25-15-7-3-13(4-8-15)11-12-20-18(23)17-19(24)27-21-22(17)14-5-9-16(26-2)10-6-14/h3-10H,11-12H2,1-2H3,(H-,20,21,23,24) | COc1ccc(cc1)CCNC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251431 | 401.436 | C19 H19 N3 O5 S | SNSAPWLGBQMTLE-UHFFFAOYSA-N | InChI=1S/C19H19N3O5S/c1-12(17(23)20-15-10-9-14(25-2)11-16(15)26-3)28-18-19(24)27-21-22(18)13-7-5-4-6-8-13/h4-12H,1-3H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccc(cc1OC)OC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251432 | 401.436 | C19 H19 N3 O5 S | DHYAYGJPQMCDFI-UHFFFAOYSA-N | InChI=1S/C19H19N3O5S/c1-12(17(23)20-15-11-14(25-2)9-10-16(15)26-3)28-18-19(24)27-21-22(18)13-7-5-4-6-8-13/h4-12H,1-3H3,(H-,20,21,23,24) | CC(C(=O)Nc1cc(ccc1OC)OC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251545 | 401.436 | C19 H19 N3 O5 S | OIXHQJBIEJYOBF-UHFFFAOYSA-N | InChI=1S/C19H19N3O5S/c1-3-26-16-7-5-4-6-15(16)20-17(23)12-28-18-19(24)27-21-22(18)13-8-10-14(25-2)11-9-13/h4-11H,3,12H2,1-2H3,(H-,20,21,23,24) | CCOc1ccccc1NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251546 | 401.436 | C19 H19 N3 O5 S | OJHZQGVWTOTIRJ-UHFFFAOYSA-N | InChI=1S/C19H19N3O5S/c1-3-26-16-8-4-13(5-9-16)20-17(23)12-28-18-19(24)27-21-22(18)14-6-10-15(25-2)11-7-14/h4-11H,3,12H2,1-2H3,(H-,20,21,23,24) | CCOc1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251828 | 401.436 | C19 H19 N3 O5 S | GUVJKXZKXLMESR-UHFFFAOYSA-N | InChI=1S/C19H19N3O5S/c1-12(17(23)20-15-6-4-5-7-16(15)26-3)28-18-19(24)27-21-22(18)13-8-10-14(25-2)11-9-13/h4-12H,1-3H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccccc1OC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251829 | 401.436 | C19 H19 N3 O5 S | UQMOYSJNXZWPGW-UHFFFAOYSA-N | InChI=1S/C19H19N3O5S/c1-12(17(23)20-13-5-4-6-16(11-13)26-3)28-18-19(24)27-21-22(18)14-7-9-15(25-2)10-8-14/h4-12H,1-3H3,(H-,20,21,23,24) | CC(C(=O)Nc1cccc(c1)OC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251836 | 401.436 | C19 H19 N3 O5 S | SELFLAXHJYEZBI-UHFFFAOYSA-N | InChI=1S/C19H19N3O5S/c1-12(17(23)20-13-4-8-15(25-2)9-5-13)28-18-19(24)27-21-22(18)14-6-10-16(26-3)11-7-14/h4-12H,1-3H3,(H-,20,21,23,24) | CC(C(=O)Nc1ccc(cc1)OC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251866 | 401.436 | C19 H19 N3 O5 S | PYWAEOOMOLPSEQ-UHFFFAOYSA-N | InChI=1S/C19H19N3O5S/c1-12(17(23)20-13-9-15(25-2)11-16(10-13)26-3)28-18-19(24)27-21-22(18)14-7-5-4-6-8-14/h4-12H,1-3H3,(H-,20,21,23,24) | CC(C(=O)Nc1cc(cc(c1)OC)OC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252187 | 401.436 | C19 H19 N3 O5 S | OYIGVHTVEMQDHH-UHFFFAOYSA-N | InChI=1S/C19H19N3O5S/c1-25-14-9-7-13(8-10-14)22-18(19(24)27-21-22)28-12-11-17(23)20-15-5-3-4-6-16(15)26-2/h3-10H,11-12H2,1-2H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccccc3OC | |
| AKOS005252188 | 401.436 | C19 H19 N3 O5 S | WLEWJSNRAIAUEA-UHFFFAOYSA-N | InChI=1S/C19H19N3O5S/c1-25-15-8-6-14(7-9-15)22-18(19(24)27-21-22)28-11-10-17(23)20-13-4-3-5-16(12-13)26-2/h3-9,12H,10-11H2,1-2H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cccc(c3)OC | |
| AKOS005252195 | 401.436 | C19 H19 N3 O5 S | LMJZZGVNZGAZSV-UHFFFAOYSA-N | InChI=1S/C19H19N3O5S/c1-25-15-7-3-13(4-8-15)20-17(23)11-12-28-18-19(24)27-21-22(18)14-5-9-16(26-2)10-6-14/h3-10H,11-12H2,1-2H3,(H-,20,21,23,24) | COc1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252246 | 401.436 | C19 H19 N3 O5 S | YQXLTORVCMRJML-UHFFFAOYSA-N | InChI=1S/C19H19N3O5S/c1-25-14-8-9-15(16(12-14)26-2)20-17(23)10-11-28-18-19(24)27-21-22(18)13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3,(H-,20,21,23,24) | COc1ccc(c(c1)OC)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252247 | 401.436 | C19 H19 N3 O5 S | UEWMVMBXIQIQRB-UHFFFAOYSA-N | InChI=1S/C19H19N3O5S/c1-25-14-8-9-16(26-2)15(12-14)20-17(23)10-11-28-18-19(24)27-21-22(18)13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3,(H-,20,21,23,24) | COc1ccc(c(c1)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-])OC | |
| AKOS005252254 | 401.436 | C19 H19 N3 O5 S | TVBBQARKMCJARV-UHFFFAOYSA-N | InChI=1S/C19H19N3O5S/c1-25-15-10-13(11-16(12-15)26-2)20-17(23)8-9-28-18-19(24)27-21-22(18)14-6-4-3-5-7-14/h3-7,10-12H,8-9H2,1-2H3,(H-,20,21,23,24) | COc1cc(cc(c1)OC)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251644 | 417.436 | C19 H19 N3 O6 S | PLPGNQCIQBJXPA-UHFFFAOYSA-N | InChI=1S/C19H19N3O6S/c1-25-13-6-4-12(5-7-13)22-18(19(24)28-21-22)29-11-17(23)20-15-9-8-14(26-2)10-16(15)27-3/h4-10H,11H2,1-3H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3OC)OC | |
| AKOS005251651 | 417.436 | C19 H19 N3 O6 S | JZMSLJATYLAAMO-UHFFFAOYSA-N | InChI=1S/C19H19N3O6S/c1-25-13-6-4-12(5-7-13)22-18(19(24)28-21-22)29-11-17(23)20-15-10-14(26-2)8-9-16(15)27-3/h4-10H,11H2,1-3H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cc(ccc3OC)OC | |
| AKOS005251652 | 417.436 | C19 H19 N3 O6 S | WXLJZBUUCLREKD-UHFFFAOYSA-N | InChI=1S/C19H19N3O6S/c1-25-14-6-4-13(5-7-14)22-18(19(24)28-21-22)29-11-17(23)20-12-8-15(26-2)10-16(9-12)27-3/h4-10H,11H2,1-3H3,(H-,20,21,23,24) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cc(cc(c3)OC)OC | |
| AKOS005250591 | 381.385 | C19 H19 N5 O4 | UDTXXDOZZFZTKT-UHFFFAOYSA-N | InChI=1S/C19H19N5O4/c1-27-15-7-5-14(6-8-15)24-17(19(26)28-21-24)18(25)23-12-10-22(11-13-23)16-4-2-3-9-20-16/h2-9H,10-13H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)c4ccccn4 | |
| AKOS005215561 | 457.529 | C19 H19 N7 O3 S2 | NZPZYPBEAXIAJF-UHFFFAOYSA-N | InChI=1S/C19H19N7O3S2/c1-10(2)26-16(15-13(8-20)17(22)30-18(23)14(15)9-21)19(29-25-26)24-31(27,28)12-6-4-11(3)5-7-12/h4-7,10,15H,22-23H2,1-3H3 | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)C3C(=C(SC(=C3C#N)N)N)C#N | |
| AKOS005250099 | 368.453 | C19 H20 N4 O2 S | OZSSGTAMIARXMY-UHFFFAOYSA-N | InChI=1S/C19H20N4O2S/c1-2-20-19(26)22(13-15-9-5-3-6-10-15)14-17-18(24)25-21-23(17)16-11-7-4-8-12-16/h3-12H,2,13-14H2,1H3,(H-,20,21,24,26) | CCNC(=S)N(Cc1ccccc1)Cc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250093 | 384.452 | C19 H20 N4 O3 S | CHYKYASLLBPDQF-UHFFFAOYSA-N | InChI=1S/C19H20N4O3S/c1-20-19(27)22(12-14-6-4-3-5-7-14)13-17-18(24)26-21-23(17)15-8-10-16(25-2)11-9-15/h3-11H,12-13H2,1-2H3,(H-,20,21,24,27) | CNC(=S)N(Cc1ccccc1)Cc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005219888 | 400.452 | C19 H20 N4 O4 S | TVTIFQMTCGQAMG-UHFFFAOYSA-N | InChI=1S/C19H20N4O4S/c1-26-16-9-7-15(8-10-16)23-17(18(25)27-21-23)13-22(11-12-24)19(28)20-14-5-3-2-4-6-14/h2-10,24H,11-13H2,1H3,(H-,20,21,25,28) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(CCO)C(=S)Nc3ccccc3 | |
| AKOS005251329 | 384.386 | C19 H20 N4 O5 | NSJHBQLWZJKKGQ-UHFFFAOYSA-N | InChI=1S/C19H20N4O5/c1-11(24)12-3-5-14(6-4-12)23-17(25)9-15(18(23)26)22(13-7-8-13)10-16-19(27)28-20-21(16)2/h3-6,13,15H,7-10H2,1-2H3 | CC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)N(Cc3c(on[n+]3C)[O-])C4CC4 | |
| AKOS005251896 | 464.515 | C19 H20 N4 O6 S2 | CPPNAPSPZCTPEM-UHFFFAOYSA-N | InChI=1S/C19H20N4O6S2/c1-3-16(17(24)21-12-4-10-15(11-5-12)31(20,26)27)30-18-19(25)29-22-23(18)13-6-8-14(28-2)9-7-13/h4-11,16H,3H2,1-2H3,(H3-,20,21,22,24,25,26,27) | CCC(C(=O)Nc1ccc(cc1)S(=O)(=O)N)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005253003 | 428.465 | C19 H20 N6 O4 S | QSJRVNHCBPMGEP-UHFFFAOYSA-N | InChI=1S/C19H20N6O4S/c26-16(21-17-11-24(22-29-17)23-7-9-28-10-8-23)12-30-19-20-15-4-2-1-3-14(15)18(27)25(19)13-5-6-13/h1-4,11,13H,5-10,12H2 | c1ccc2c(c1)c(=O)n(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)C5CC5 | |
| AKOS005253518 | 444.464 | C19 H20 N6 O5 S | IZUZBJDKDCHRPY-UHFFFAOYSA-N | InChI=1S/C19H20N6O5S/c1-23-14(18(29)30-22-23)9-24-13(17(28)25(19(24)31)12-6-7-12)8-15(26)21-11-4-2-10(3-5-11)16(20)27/h2-5,12-13H,6-9H2,1H3,(H3-,20,21,22,26,27,29) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C3CC3)CC(=O)Nc4ccc(cc4)C(=O)N | |
| AKOS005253078 | 424.48 | C19 H20 N8 O2 S | BQMYYGRIYFAACU-UHFFFAOYSA-N | InChI=1S/C19H20N8O2S/c20-8-13-17(12-4-5-12)14(9-21)19(24-18(13)22)30-11-15(28)23-16-10-27(25-29-16)26-6-2-1-3-7-26/h10,12H,1-7,11H2,(H2-,22,23,24,25,28) | c1c(on[n+]1N2CCCCC2)[N-]C(=O)CSc3c(c(c(c(n3)N)C#N)C4CC4)C#N | |
| AKOS005214756 | 339.388 | C19 H21 N3 O3 | TUNVDVOZOTUCJM-UHFFFAOYSA-N | InChI=1S/C19H21N3O3/c1-14-3-7-16(8-4-14)22-18(19(23)25-21-22)13-20-12-11-15-5-9-17(24-2)10-6-15/h3-10,20H,11-13H2,1-2H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccc(cc3)OC | |
| AKOS005214784 | 339.388 | C19 H21 N3 O3 | ZLTFEMYNVQLDMF-UHFFFAOYSA-N | InChI=1S/C19H21N3O3/c1-14-7-9-16(10-8-14)22-17(19(23)25-21-22)13-20-12-11-15-5-3-4-6-18(15)24-2/h3-10,20H,11-13H2,1-2H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccccc3OC | |
| AKOS005214156 | 355.388 | C19 H21 N3 O4 | DNGITONWPINDJM-UHFFFAOYSA-N | InChI=1S/C19H21N3O4/c1-24-17-9-8-14(12-18(17)25-2)10-11-20-13-16-19(23)26-21-22(16)15-6-4-3-5-7-15/h3-9,12,20H,10-11,13H2,1-2H3 | COc1ccc(cc1OC)CCNCc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005214763 | 355.388 | C19 H21 N3 O4 | ZKPDUIFHWRHRPK-UHFFFAOYSA-N | InChI=1S/C19H21N3O4/c1-24-16-7-3-14(4-8-16)11-12-20-13-18-19(23)26-21-22(18)15-5-9-17(25-2)10-6-15/h3-10,20H,11-13H2,1-2H3 | COc1ccc(cc1)CCNCc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005214794 | 355.388 | C19 H21 N3 O4 | GGQYHHPWXMFZHZ-UHFFFAOYSA-N | InChI=1S/C19H21N3O4/c1-24-16-9-7-15(8-10-16)22-17(19(23)26-21-22)13-20-12-11-14-5-3-4-6-18(14)25-2/h3-10,20H,11-13H2,1-2H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccccc3OC | |
| AKOS005251281 | 435.517 | C19 H21 N3 O5 S2 | ZJGDVCADBPRNPY-UHFFFAOYSA-N | InChI=1S/C19H21N3O5S2/c1-2-26-17(24)13-8-10-21(11-9-13)19(28)29-12-15(23)16-18(25)27-20-22(16)14-6-4-3-5-7-14/h3-7,13H,2,8-12H2,1H3 | CCOC(=O)C1CCN(CC1)C(=S)SCC(=O)c2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005253130 | 415.532 | C19 H21 N5 O2 S2 | ISRNEXZIWGUEPC-UHFFFAOYSA-N | InChI=1S/C19H21N5O2S2/c1-14-5-7-15(8-6-14)16-12-27-19(20-16)28-13-17(25)21-18-11-24(22-26-18)23-9-3-2-4-10-23/h5-8,11-12H,2-4,9-10,13H2,1H3 | Cc1ccc(cc1)c2csc(n2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4 | |
| AKOS005253022 | 431.532 | C19 H21 N5 O3 S2 | SUWKELLBZOHPSR-UHFFFAOYSA-N | InChI=1S/C19H21N5O3S2/c1-26-15-7-5-14(6-8-15)16-12-28-19(20-16)29-13-17(25)21-18-11-24(22-27-18)23-9-3-2-4-10-23/h5-8,11-12H,2-4,9-10,13H2,1H3 | COc1ccc(cc1)c2csc(n2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4 | |
| AKOS005253469 | 415.466 | C19 H21 N5 O4 S | CFGOEKFNFIFOSR-UHFFFAOYSA-N | InChI=1S/C19H21N5O4S/c1-11-3-5-12(6-4-11)20-16(25)9-14-17(26)24(13-7-8-13)19(29)23(14)10-15-18(27)28-21-22(15)2/h3-6,13-14H,7-10H2,1-2H3,(H-,20,21,25,27) | Cc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])C4CC4 | |
| AKOS005250950 | 399.401 | C19 H21 N5 O5 | KQSCDERBKDYMMI-UHFFFAOYSA-O | InChI=1S/C19H20N5O5/c1-23-15(19(28)29-22-23)11-14(21-17(26)13-5-3-2-4-6-13)18(27)24-9-7-12(8-10-24)16(20)25/h2-6,11-12H,7-10H2,1H3,(H2,20,25)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCC(CC2)C(=O)N)\NC(=O)c3ccccc3 | |
| AKOS005250957 | 399.401 | C19 H21 N5 O5 | UFCYPSXOSISFEB-UHFFFAOYSA-O | InChI=1S/C19H20N5O5/c1-23-15(19(28)29-22-23)10-14(21-17(26)12-6-3-2-4-7-12)18(27)24-9-5-8-13(11-24)16(20)25/h2-4,6-7,10,13H,5,8-9,11H2,1H3,(H2,20,25)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCCC(C2)C(=O)N)\NC(=O)c3ccccc3 | |
| AKOS005250964 | 399.401 | C19 H21 N5 O5 | KGDRRAPLKUIMDQ-UHFFFAOYSA-O | InChI=1S/C19H20N5O5/c1-13(25)23-8-10-24(11-9-23)18(27)15(12-16-19(28)29-21-22(16)2)20-17(26)14-6-4-3-5-7-14/h3-7,12H,8-11H2,1-2H3/q-1/p+1 | CC(=O)N1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2C)[O-])/NC(=O)c3ccccc3 | |
| AKOS005251348 | 399.401 | C19 H21 N5 O5 | ZIFPUEGYUXZHCP-UHFFFAOYSA-N | InChI=1S/C19H21N5O5/c1-11(25)20-12-3-5-14(6-4-12)24-17(26)9-15(18(24)27)23(13-7-8-13)10-16-19(28)29-21-22(16)2/h3-6,13,15H,7-10H2,1-2H3,(H-,20,21,25,28) | CC(=O)Nc1ccc(cc1)N2C(=O)CC(C2=O)N(Cc3c(on[n+]3C)[O-])C4CC4 | |
| AKOS005253470 | 431.466 | C19 H21 N5 O5 S | NCULAHVUHIAYHK-UHFFFAOYSA-N | InChI=1S/C19H21N5O5S/c1-22-15(18(27)29-21-22)10-23-14(17(26)24(19(23)30)12-5-6-12)9-16(25)20-11-3-7-13(28-2)8-4-11/h3-4,7-8,12,14H,5-6,9-10H2,1-2H3,(H-,20,21,25,27) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C3CC3)CC(=O)Nc4ccc(cc4)OC | |
| AKOS005253476 | 431.466 | C19 H21 N5 O5 S | CXXMJWXSZBGNJJ-UHFFFAOYSA-N | InChI=1S/C19H21N5O5S/c1-4-23-17(27)14(24(19(23)30)10-15-18(28)29-21-22(15)3)9-16(26)20-13-7-5-12(6-8-13)11(2)25/h5-8,14H,4,9-10H2,1-3H3,(H-,20,21,25,26,28) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)C(=O)C | |
| AKOS005253483 | 447.465 | C19 H21 N5 O6 S | DRDGLZBYWROHIO-UHFFFAOYSA-N | InChI=1S/C19H21N5O6S/c1-4-23-16(26)13(24(19(23)31)10-14-18(28)30-21-22(14)2)9-15(25)20-12-7-5-11(6-8-12)17(27)29-3/h5-8,13H,4,9-10H2,1-3H3,(H-,20,21,25,27,28) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)C(=O)OC | |
| AKOS005253489 | 447.465 | C19 H21 N5 O6 S | JCTWEYLHOHLKNU-UHFFFAOYSA-N | InChI=1S/C19H21N5O6S/c1-4-29-17(27)11-5-7-12(8-6-11)20-15(25)9-13-16(26)22(2)19(31)24(13)10-14-18(28)30-21-23(14)3/h5-8,13H,4,9-10H2,1-3H3,(H-,20,21,25,27,28) | CCOC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])C | |
| AKOS005219539 | 386.468 | C19 H22 N4 O3 S | BFYMTSGNDZIMDA-UHFFFAOYSA-N | InChI=1S/C19H22N4O3S/c1-19(2,3)13-5-6-14-11(8-13)7-12(9-20)17(21-14)27-10-15(24)16-18(25)26-22-23(16)4/h7,13H,5-6,8,10H2,1-4H3 | CC(C)(C)C1CCc2c(cc(c(n2)SCC(=O)c3c(on[n+]3C)[O-])C#N)C1 | |
| AKOS005253862 | 386.468 | C19 H22 N4 O3 S | AZAMMMAEWBRRKQ-UHFFFAOYSA-N | InChI=1S/C19H22N4O3S/c1-19(2,3)10-5-6-12-9(7-10)8-11-13(20)16(27-17(11)21-12)15(24)14-18(25)26-22-23(14)4/h8,10H,5-7H2,1-4H3,(H2-,20,22,24,25) | CC(C)(C)C1CCc2c(cc3c(c(sc3n2)C(=O)c4c(on[n+]4C)[O-])N)C1 | |
| AKOS005250894 | 370.402 | C19 H22 N4 O4 | SIDFEASJUPGBLA-UHFFFAOYSA-O | InChI=1S/C19H21N4O4/c1-13-8-10-23(11-9-13)18(25)15(12-16-19(26)27-21-22(16)2)20-17(24)14-6-4-3-5-7-14/h3-7,12-13H,8-11H2,1-2H3/q-1/p+1 | CC1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2C)[O-])/NC(=O)c3ccccc3 | |
| AKOS005250920 | 370.402 | C19 H22 N4 O4 | VDFCIXJMXPMVIM-UHFFFAOYSA-O | InChI=1S/C19H21N4O4/c1-23-16(19(26)27-22-23)12-15(18(25)20-14-10-6-3-7-11-14)21-17(24)13-8-4-2-5-9-13/h2,4-5,8-9,12,14H,3,6-7,10-11H2,1H3,(H,20,25)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NC2CCCCC2)\NC(=O)c3ccccc3 | |
| AKOS005250965 | 370.402 | C19 H22 N4 O4 | SRIORJZRCQIZMJ-UHFFFAOYSA-O | InChI=1S/C19H21N4O4/c1-13-8-6-7-11-23(13)18(25)15(12-16-19(26)27-21-22(16)2)20-17(24)14-9-4-3-5-10-14/h3-5,9-10,12-13H,6-8,11H2,1-2H3/q-1/p+1 | CC1CCCCN1C(=O)/C(=C/c2c(on[n+]2C)[O-])/NC(=O)c3ccccc3 | |
| AKOS005250966 | 370.402 | C19 H22 N4 O4 | CJSTXLSVCZSINP-UHFFFAOYSA-O | InChI=1S/C19H21N4O4/c1-13-7-6-10-23(12-13)18(25)15(11-16-19(26)27-21-22(16)2)20-17(24)14-8-4-3-5-9-14/h3-5,8-9,11,13H,6-7,10,12H2,1-2H3/q-1/p+1 | CC1CCCN(C1)C(=O)/C(=C/c2c(on[n+]2C)[O-])/NC(=O)c3ccccc3 | |
| AKOS005250958 | 386.402 | C19 H22 N4 O5 | KBZAQSIIOGUEPW-UHFFFAOYSA-O | InChI=1S/C19H21N4O5/c1-12-10-23(11-13(2)27-12)18(25)15(9-16-19(26)28-21-22(16)3)20-17(24)14-7-5-4-6-8-14/h4-9,12-13H,10-11H2,1-3H3/q-1/p+1 | CC1CN(CC(O1)C)C(=O)/C(=C/c2c(on[n+]2C)[O-])/NC(=O)c3ccccc3 | |
| AKOS005251328 | 386.402 | C19 H22 N4 O5 | JOOHTVVTRYOGKF-UHFFFAOYSA-N | InChI=1S/C19H22N4O5/c1-3-27-14-8-6-13(7-9-14)23-17(24)10-15(18(23)25)22(12-4-5-12)11-16-19(26)28-20-21(16)2/h6-9,12,15H,3-5,10-11H2,1-2H3 | CCOc1ccc(cc1)N2C(=O)CC(C2=O)N(Cc3c(on[n+]3C)[O-])C4CC4 | |
| AKOS005219812 | 418.401 | C19 H22 N4 O7 | OPHZLTOXUHTZGW-UHFFFAOYSA-N | InChI=1S/C19H22N4O7/c1-3-28-18(26)12-4-6-13(7-5-12)20-16(24)10-15-17(25)23(8-9-29-15)11-14-19(27)30-21-22(14)2/h4-7,15H,3,8-11H2,1-2H3,(H-,20,21,24,26,27) | CCOC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3C)[O-] | |
| AKOS005253153 | 398.482 | C19 H22 N6 O2 S | KWXKHWRFHWAMCU-UHFFFAOYSA-N | InChI=1S/C19H22N6O2S/c20-11-15-10-14-6-2-3-7-16(14)21-19(15)28-13-17(26)22-18-12-25(23-27-18)24-8-4-1-5-9-24/h10,12H,1-9,13H2 | c1c2c(nc(c1C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)CCCC2 | |
| AKOS005252940 | 414.481 | C19 H22 N6 O3 S | XNVMLAGEBVYDOJ-UHFFFAOYSA-N | InChI=1S/C19H22N6O3S/c1-13-2-3-16-14(8-13)9-15(10-20)19(21-16)29-12-17(26)22-18-11-25(23-28-18)24-4-6-27-7-5-24/h9,11,13H,2-8,12H2,1H3 | CC1CCc2c(cc(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)C#N)C1 | |
| AKOS005253036 | 414.481 | C19 H22 N6 O3 S | NIAZRIQUPWGETR-UHFFFAOYSA-N | InChI=1S/C19H22N6O3S/c20-11-15-10-14-4-2-1-3-5-16(14)21-19(15)29-13-17(26)22-18-12-25(23-28-18)24-6-8-27-9-7-24/h10,12H,1-9,13H2 | c1c2c(nc(c1C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)CCCCC2 | |
| AKOS005253151 | 414.481 | C19 H22 N6 O3 S | UHYCLBQLEIRSAN-UHFFFAOYSA-N | InChI=1S/C19H22N6O3S/c1-2-24-18(27)14-8-4-5-9-15(14)20-19(24)29-13-16(26)21-17-12-25(22-28-17)23-10-6-3-7-11-23/h4-5,8-9,12H,2-3,6-7,10-11,13H2,1H3 | CCn1c(=O)c2ccccc2nc1SCC(=O)[N-]c3c[n+](no3)N4CCCCC4 | |
| AKOS005253144 | 430.481 | C19 H22 N6 O4 S | UVJMSVNMWSWLQJ-UHFFFAOYSA-N | InChI=1S/C19H22N6O4S/c1-3-28-19(27)14-9-13(2)21-18(15(14)10-20)30-12-16(26)22-17-11-25(23-29-17)24-7-5-4-6-8-24/h9,11H,3-8,12H2,1-2H3 | CCOC(=O)c1cc(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3)C | |
| AKOS005253491 | 446.48 | C19 H22 N6 O5 S | OJCDZPTVXTWUOM-UHFFFAOYSA-N | InChI=1S/C19H22N6O5S/c1-4-24-17(28)14(25(19(24)31)10-15-18(29)30-22-23(15)3)9-16(27)21-13-7-5-12(6-8-13)20-11(2)26/h5-8,14,22,29H,4,9-10H2,1-3H3 | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)NC(=O)C | |
| AKOS005253125 | 426.495 | C19 H22 N8 O2 S | GBTCICZQABUVCO-UHFFFAOYSA-N | InChI=1S/C19H22N8O2S/c1-12(2)17-13(8-20)18(22)24-19(14(17)9-21)30-11-15(28)23-16-10-27(25-29-16)26-6-4-3-5-7-26/h10,12H,3-7,11H2,1-2H3,(H2-,22,23,24,25,28) | CC(C)c1c(c(nc(c1C#N)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3)N)C#N | |
| AKOS005250341 | 341.404 | C19 H23 N3 O3 | TWMUGKAOQVQDCR-UHFFFAOYSA-N | InChI=1S/C19H23N3O3/c23-18(14-7-3-1-4-8-14)21(15-11-12-15)13-17-19(24)25-20-22(17)16-9-5-2-6-10-16/h2,5-6,9-10,14-15H,1,3-4,7-8,11-13H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)C4CCCCC4 | |
| AKOS005219560 | 421.534 | C19 H23 N3 O4 S2 | ZFDYIXZROSHQQQ-UHFFFAOYSA-N | InChI=1S/C19H23N3O4S2/c1-12-5-4-6-13(2)21(12)19(27)28-11-16(23)17-18(24)26-20-22(17)14-7-9-15(25-3)10-8-14/h7-10,12-13H,4-6,11H2,1-3H3 | CC1CCCC(N1C(=S)SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005219474 | 353.418 | C19 H23 N5 O2 | YABQYDRHRYJXHE-UHFFFAOYSA-N | InChI=1S/C19H23N5O2/c1-11(2)24-15(16(26-23-24)22-17(25)18(3,4)5)14-12-6-7-13(8-12)19(14,9-20)10-21/h6-7,11-14H,8H2,1-5H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)C(C)(C)C)C2C3CC(C2(C#N)C#N)C=C3 | |
| AKOS005219456 | 385.483 | C19 H23 N5 O2 S | ZOWAVGWPDDCOQS-UHFFFAOYSA-N | InChI=1S/C19H23N5O2S/c1-13(2)24-11-18(26-23-24)22-17(25)12-27-19-15(10-20)9-14-7-5-3-4-6-8-16(14)21-19/h9,11,13H,3-8,12H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCCCCC3)C#N | |
| AKOS005252532 | 385.483 | C19 H23 N5 O2 S | VUFWKSPMYRZBJR-UHFFFAOYSA-N | InChI=1S/C19H23N5O2S/c1-19(2,3)14-5-6-15-12(8-14)7-13(9-20)18(21-15)27-11-16(25)22-17-10-24(4)23-26-17/h7,10,14H,5-6,8,11H2,1-4H3 | CC(C)(C)C1CCc2c(cc(c(n2)SCC(=O)[N-]c3c[n+](no3)C)C#N)C1 | |
| AKOS005253308 | 401.483 | C19 H23 N5 O3 S | VLJVYOGAVIIKLY-UHFFFAOYSA-N | InChI=1S/C19H23N5O3S/c1-26-9-8-24-12-18(27-23-24)22-17(25)13-28-19-15(11-20)10-14-6-4-2-3-5-7-16(14)21-19/h10,12H,2-9,13H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCCCCC3)C#N | |
| AKOS005250910 | 385.417 | C19 H23 N5 O4 | UUWBLYPPILDEAB-UHFFFAOYSA-O | InChI=1S/C19H22N5O4/c1-22-9-6-10-24(12-11-22)18(26)15(13-16-19(27)28-21-23(16)2)20-17(25)14-7-4-3-5-8-14/h3-5,7-8,13H,6,9-12H2,1-2H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCCN(CC2)C)\NC(=O)c3ccccc3 | |
| AKOS005250931 | 385.417 | C19 H23 N5 O4 | TXMSAWFWVKQAJZ-UHFFFAOYSA-O | InChI=1S/C19H22N5O4/c1-3-23-9-11-24(12-10-23)18(26)15(13-16-19(27)28-21-22(16)2)20-17(25)14-7-5-4-6-8-14/h4-8,13H,3,9-12H2,1-2H3/q-1/p+1 | CCN1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2C)[O-])/NC(=O)c3ccccc3 | |
| AKOS005250930 | 401.416 | C19 H23 N5 O5 | OLUSXSMINGDCEK-UHFFFAOYSA-O | InChI=1S/C19H22N5O5/c1-23-16(19(27)29-22-23)13-15(21-17(25)14-5-3-2-4-6-14)18(26)20-7-8-24-9-11-28-12-10-24/h2-6,13H,7-12H2,1H3,(H,20,26)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCN2CCOCC2)\NC(=O)c3ccccc3 | |
| AKOS005250956 | 401.416 | C19 H23 N5 O5 | XGOHINMVNYKBOH-UHFFFAOYSA-O | InChI=1S/C19H22N5O5/c1-22-16(19(28)29-21-22)13-15(20-17(26)14-5-3-2-4-6-14)18(27)24-9-7-23(8-10-24)11-12-25/h2-6,13,25H,7-12H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCN(CC2)CCO)\NC(=O)c3ccccc3 | |
| AKOS005253467 | 433.481 | C19 H23 N5 O5 S | SRVRPZCAVLXYNA-UHFFFAOYSA-N | InChI=1S/C19H23N5O5S/c1-4-23-17(26)14(24(19(23)30)11-15-18(27)29-21-22(15)3)10-16(25)20-12-6-8-13(9-7-12)28-5-2/h6-9,14H,4-5,10-11H2,1-3H3,(H-,20,21,25,27) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)OCC | |
| AKOS005251752 | 465.546 | C19 H23 N5 O5 S2 | VCGGIGHXAKDOOR-UHFFFAOYSA-N | InChI=1S/C19H23N5O5S2/c1-10(30-16-17(26)29-22-23(16)5)14(25)21-15-12(8-20)11-6-7-24(9-13(11)31-15)18(27)28-19(2,3)4/h10H,6-7,9H2,1-5H3,(H-,21,22,25,26) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)OC(C)(C)C)C#N)Sc3c(on[n+]3C)[O-] | |
| AKOS005252542 | 465.546 | C19 H23 N5 O5 S2 | VJTMBQNMOSJGKF-UHFFFAOYSA-N | InChI=1S/C19H23N5O5S2/c1-19(2,3)28-18(27)24-7-5-11-12(9-20)15(31-13(11)10-24)21-14(25)6-8-30-16-17(26)29-22-23(16)4/h5-8,10H2,1-4H3,(H-,21,22,25,26) | CC(C)(C)OC(=O)N1CCc2c(sc(c2C#N)NC(=O)CCSc3c(on[n+]3C)[O-])C1 | |
| AKOS005253386 | 467.008 | C19 H23 N6 O2 S2 . Cl | DLZCFTORVWVABM-UHFFFAOYSA-N | InChI=1S/C19H22N6O2S2.ClH/c20-10-15-13-6-2-3-7-14(13)19(29-18(15)21)28-12-16(26)22-17-11-25(23-27-17)24-8-4-1-5-9-24;/h11,21H,1-9,12H2;1H | c1c(on[n+]1N2CCCCC2)[N-]C(=O)CSc3c4c(c(c([s+]3)N)C#N)CCCC4.[Cl-] | |
| AKOS005251857 | 420.549 | C19 H24 N4 O3 S2 | IOQSXKLHKOGSHM-UHFFFAOYSA-N | InChI=1S/C19H24N4O3S2/c1-10(27-17-18(25)26-22-23(17)5)15(24)21-16-13(9-20)12-7-6-11(19(2,3)4)8-14(12)28-16/h10-11H,6-8H2,1-5H3,(H-,21,22,24,25) | CC(C(=O)Nc1c(c2c(s1)CC(CC2)C(C)(C)C)C#N)Sc3c(on[n+]3C)[O-] | |
| AKOS005252666 | 420.549 | C19 H24 N4 O3 S2 | ZJLPKAHBICLGMZ-UHFFFAOYSA-N | InChI=1S/C19H24N4O3S2/c1-19(2,3)11-5-6-12-13(10-20)16(28-14(12)9-11)21-15(24)7-8-27-17-18(25)26-22-23(17)4/h11H,5-9H2,1-4H3,(H-,21,22,24,25) | CC(C)(C)C1CCc2c(sc(c2C#N)NC(=O)CCSc3c(on[n+]3C)[O-])C1 | |
| AKOS005250603 | 404.417 | C19 H24 N4 O6 | PCZNMUOYLZDTAT-UHFFFAOYSA-N | InChI=1S/C19H24N4O6/c1-19(2,3)28-18(26)22-11-9-21(10-12-22)16(24)15-17(25)29-20-23(15)13-5-7-14(27-4)8-6-13/h5-8H,9-12H2,1-4H3 | CC(C)(C)OC(=O)N1CCN(CC1)C(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251946 | 468.547 | C19 H24 N4 O6 S2 | ITBJZUYLGPOSLF-UHFFFAOYSA-N | InChI=1S/C19H24N4O6S2/c1-5-12(31-17-19(27)29-21-22(17)4)15(25)20-16-14(18(26)28-6-2)11-7-8-23(10(3)24)9-13(11)30-16/h12H,5-9H2,1-4H3,(H-,20,21,25,26,27) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)C)C(=O)OCC)Sc3c(on[n+]3C)[O-] | |
| AKOS005250623 | 452.481 | C19 H24 N4 O7 S | NDOMZRFEKIRSSK-UHFFFAOYSA-N | InChI=1S/C19H24N4O7S/c1-6-28-16(25)12-10-7-8-23(18(27)29-19(2,3)4)9-11(10)31-15(12)20-14(24)13-17(26)30-21-22(13)5/h6-9H2,1-5H3,(H-,20,21,24,25,26) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3C)[O-])CN(CC2)C(=O)OC(C)(C)C | |
| AKOS005251578 | 484.546 | C19 H24 N4 O7 S2 | ONFHCEMRPWIEPO-UHFFFAOYSA-N | InChI=1S/C19H24N4O7S2/c1-19(2,3)29-18(27)23-7-6-10-11(8-23)32-14(13(10)16(25)28-5)20-12(24)9-31-15-17(26)30-21-22(15)4/h6-9H2,1-5H3,(H-,20,21,24,25,26) | CC(C)(C)OC(=O)N1CCc2c(sc(c2C(=O)OC)NC(=O)CSc3c(on[n+]3C)[O-])C1 | |
| AKOS005253083 | 400.498 | C19 H24 N6 O2 S | RZQNFXYXMMLCPJ-UHFFFAOYSA-N | InChI=1S/C19H24N6O2S/c1-14(2)10-16-7-6-15(11-20)19(21-16)28-13-17(26)22-18-12-25(23-27-18)24-8-4-3-5-9-24/h6-7,12,14H,3-5,8-10,13H2,1-2H3 | CC(C)Cc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3)C#N | |
| AKOS005253090 | 400.498 | C19 H24 N6 O2 S | AAHOFKWLAUYHCS-UHFFFAOYSA-N | InChI=1S/C19H24N6O2S/c1-2-3-7-16-9-8-15(12-20)19(21-16)28-14-17(26)22-18-13-25(23-27-18)24-10-5-4-6-11-24/h8-9,13H,2-7,10-11,14H2,1H3 | CCCCc1ccc(c(n1)SCC(=O)[N-]c2c[n+](no2)N3CCCCC3)C#N | |
| AKOS005250291 | 359.42 | C19 H25 N3 O4 | HOGFAKIOLXVQDG-UHFFFAOYSA-N | InChI=1S/C19H25N3O4/c1-19(2,3)11-17(23)21(13-5-6-13)12-16-18(24)26-20-22(16)14-7-9-15(25-4)10-8-14/h7-10,13H,5-6,11-12H2,1-4H3 | CC(C)(C)CC(=O)N(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C3CC3 | |
| AKOS005250580 | 407.484 | C19 H25 N3 O5 S | OXBNHKUNXULRGG-UHFFFAOYSA-N | InChI=1S/C19H25N3O5S/c1-6-26-17(24)13-11-8-7-10(19(2,3)4)9-12(11)28-16(13)20-15(23)14-18(25)27-21-22(14)5/h10H,6-9H2,1-5H3,(H-,20,21,23,24,25) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3C)[O-])CC(CC2)C(C)(C)C | |
| AKOS005251608 | 439.549 | C19 H25 N3 O5 S2 | CYRSYORHTMMNTN-UHFFFAOYSA-N | InChI=1S/C19H25N3O5S2/c1-19(2,3)10-6-7-11-12(8-10)29-15(14(11)17(24)26-5)20-13(23)9-28-16-18(25)27-21-22(16)4/h10H,6-9H2,1-5H3,(H-,20,21,23,24,25) | CC(C)(C)C1CCc2c(sc(c2C(=O)OC)NC(=O)CSc3c(on[n+]3C)[O-])C1 | |
| AKOS005251808 | 439.549 | C19 H25 N3 O5 S2 | DYCUWABURNGXLO-UHFFFAOYSA-N | InChI=1S/C19H25N3O5S2/c1-4-26-18(24)14-12-9-7-5-6-8-10-13(12)29-16(14)20-15(23)11(2)28-17-19(25)27-21-22(17)3/h11H,4-10H2,1-3H3,(H-,20,21,23,24,25) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3C)[O-])CCCCCC2 | |
| AKOS005251960 | 439.549 | C19 H25 N3 O5 S2 | MCZKXOVGWKDAJP-UHFFFAOYSA-N | InChI=1S/C19H25N3O5S2/c1-4-12(29-17-19(25)27-21-22(17)3)15(23)20-16-14(18(24)26-5-2)11-9-7-6-8-10-13(11)28-16/h12H,4-10H2,1-3H3,(H-,20,21,23,24,25) | CCC(C(=O)Nc1c(c2c(s1)CCCCC2)C(=O)OCC)Sc3c(on[n+]3C)[O-] | |
| AKOS005251966 | 439.549 | C19 H25 N3 O5 S2 | MWDKUPSIZVRSAJ-UHFFFAOYSA-N | InChI=1S/C19H25N3O5S2/c1-4-12(29-17-19(25)27-21-22(17)2)15(23)20-16-14(18(24)26-3)11-9-7-5-6-8-10-13(11)28-16/h12H,4-10H2,1-3H3,(H-,20,21,23,24,25) | CCC(C(=O)Nc1c(c2c(s1)CCCCCC2)C(=O)OC)Sc3c(on[n+]3C)[O-] | |
| AKOS005251982 | 439.549 | C19 H25 N3 O5 S2 | SSRBYPRXLZMXIW-UHFFFAOYSA-N | InChI=1S/C19H25N3O5S2/c1-5-12(29-17-19(25)27-21-22(17)4)15(23)20-16-14(18(24)26-6-2)11-8-7-10(3)9-13(11)28-16/h10,12H,5-9H2,1-4H3,(H-,20,21,23,24,25) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C)C(=O)OCC)Sc3c(on[n+]3C)[O-] | |
| AKOS005252651 | 439.549 | C19 H25 N3 O5 S2 | AILVHOHHCWMAHK-UHFFFAOYSA-N | InChI=1S/C19H25N3O5S2/c1-3-26-18(24)15-12-8-6-4-5-7-9-13(12)29-16(15)20-14(23)10-11-28-17-19(25)27-21-22(17)2/h3-11H2,1-2H3,(H-,20,21,23,24,25) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3C)[O-])CCCCCC2 | |
| AKOS005253471 | 547.366 | C19 H8 F7 N7 O3 S | ZGYQDNCLMXQMTE-UHFFFAOYSA-N | InChI=1S/C19H8F7N7O3S/c1-33-13(18(35)36-32-33)4-3(2-27)15(29)31-17-5(4)11(28)14(37-17)16(34)30-12-9(22)7(20)6(19(24,25)26)8(21)10(12)23/h1H3,(H5-,28,29,30,31,32,34,35) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4c(c(c(c(c4F)F)C(F)(F)F)F)F)N)N)C#N | |
| AKOS005253607 | 547.366 | C19 H8 F7 N7 O3 S | YUDURBHBRXHGLI-UHFFFAOYSA-N | InChI=1S/C19H8F7N7O3S/c1-33-15(18(35)36-32-33)8-5(2-27)16(29)31-17(6(8)3-28)37-4-7(34)30-14-12(22)10(20)9(19(24,25)26)11(21)13(14)23/h4H2,1H3,(H3-,29,30,31,32,34,35) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3c(c(c(c(c3F)F)C(F)(F)F)F)F)N)C#N | |
| AKOS005253211 | 561.392 | C20 H10 F7 N7 O3 S | SSZFKMLTAIGXQS-UHFFFAOYSA-N | InChI=1S/C20H10F7N7O3S/c1-5(17(35)31-14-12(23)10(21)9(20(25,26)27)11(22)13(14)24)38-18-7(4-29)8(6(3-28)16(30)32-18)15-19(36)37-33-34(15)2/h5H,1-2H3,(H3-,30,31,32,33,35,36) | CC(C(=O)Nc1c(c(c(c(c1F)F)C(F)(F)F)F)F)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253207 | 523.876 | C20 H13 Cl F3 N7 O3 S | LKYPVAVZTBMITF-UHFFFAOYSA-N | InChI=1S/C20H13ClF3N7O3S/c1-8(17(32)28-13-4-3-9(21)5-12(13)20(22,23)24)35-18-11(7-26)14(10(6-25)16(27)29-18)15-19(33)34-30-31(15)2/h3-5,8H,1-2H3,(H3-,27,28,29,30,32,33) | CC(C(=O)Nc1ccc(cc1C(F)(F)F)Cl)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253214 | 523.876 | C20 H13 Cl F3 N7 O3 S | CHCANEPGGRAWLB-UHFFFAOYSA-N | InChI=1S/C20H13ClF3N7O3S/c1-8(17(32)28-13-5-9(20(22,23)24)3-4-12(13)21)35-18-11(7-26)14(10(6-25)16(27)29-18)15-19(33)34-30-31(15)2/h3-5,8H,1-2H3,(H3-,27,28,29,30,32,33) | CC(C(=O)Nc1cc(ccc1Cl)C(F)(F)F)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253786 | 431.427 | C20 H13 N7 O3 S | IIWUTVCVKLCMGB-UHFFFAOYSA-N | InChI=1S/C20H13N7O3S/c1-27-15(20(29)30-26-27)16(28)17-14(22)13-12(10(7-21)18(23)25-19(13)31-17)9-3-2-4-11-8(9)5-6-24-11/h2-6H,1H3,(H5-,22,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4cccc5c4cc[nH]5)N | |
| AKOS005250784 | 459.926 | C20 H14 Cl N3 O4 S2 | QUOXZRVYLPNGSN-UHFFFAOYSA-N | InChI=1S/C20H14ClN3O4S2/c1-27-15-8-6-14(7-9-15)24-18(19(26)28-23-24)17(25)11-30-20-22-16(10-29-20)12-2-4-13(21)5-3-12/h2-10H,11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nc(cs3)c4ccc(cc4)Cl | |
| AKOS005253240 | 499.887 | C20 H14 Cl N7 O5 S | AATQZUWJVACFTP-UHFFFAOYSA-N | InChI=1S/C20H14ClN7O5S/c1-8(17(29)25-9-3-4-13(21)10(5-9)19(30)31)34-18-12(7-23)14(11(6-22)16(24)26-18)15-20(32)33-27-28(15)2/h3-5,8H,1-2H3,(H4-,24,25,26,27,29,30,31,32) | CC(C(=O)Nc1ccc(c(c1)C(=O)O)Cl)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253241 | 499.887 | C20 H14 Cl N7 O5 S | KFJLDOZMPCHJHY-UHFFFAOYSA-N | InChI=1S/C20H14ClN7O5S/c1-8(17(29)25-13-5-9(19(30)31)3-4-12(13)21)34-18-11(7-23)14(10(6-22)16(24)26-18)15-20(32)33-27-28(15)2/h3-5,8H,1-2H3,(H4-,24,25,26,27,29,30,31,32) | CC(C(=O)Nc1cc(ccc1Cl)C(=O)O)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253186 | 489.43 | C20 H14 F3 N7 O3 S | VGEFFIRJNXUADE-UHFFFAOYSA-N | InChI=1S/C20H14F3N7O3S/c1-9(17(31)27-13-6-4-3-5-12(13)20(21,22)23)34-18-11(8-25)14(10(7-24)16(26)28-18)15-19(32)33-29-30(15)2/h3-6,9H,1-2H3,(H3-,26,27,28,29,31,32) | CC(C(=O)Nc1ccccc1C(F)(F)F)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253189 | 489.43 | C20 H14 F3 N7 O3 S | FOUCXRKYYGMBQQ-UHFFFAOYSA-N | InChI=1S/C20H14F3N7O3S/c1-9(17(31)27-11-5-3-4-10(6-11)20(21,22)23)34-18-13(8-25)14(12(7-24)16(26)28-18)15-19(32)33-29-30(15)2/h3-6,9H,1-2H3,(H3-,26,27,28,29,31,32) | CC(C(=O)Nc1cccc(c1)C(F)(F)F)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253218 | 505.43 | C20 H14 F3 N7 O4 S | SOCNJKAHWIAGQS-UHFFFAOYSA-N | InChI=1S/C20H14F3N7O4S/c1-9(17(31)27-12-5-3-4-6-13(12)33-20(21,22)23)35-18-11(8-25)14(10(7-24)16(26)28-18)15-19(32)34-29-30(15)2/h3-6,9H,1-2H3,(H3-,26,27,28,29,31,32) | CC(C(=O)Nc1ccccc1OC(F)(F)F)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253251 | 505.43 | C20 H14 F3 N7 O4 S | UALSGRDXKHHXRQ-UHFFFAOYSA-N | InChI=1S/C20H14F3N7O4S/c1-9(17(31)27-10-3-5-11(6-4-10)33-20(21,22)23)35-18-13(8-25)14(12(7-24)16(26)28-18)15-19(32)34-29-30(15)2/h3-6,9H,1-2H3,(H3-,26,27,28,29,31,32) | CC(C(=O)Nc1ccc(cc1)OC(F)(F)F)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005251898 | 525.397 | C20 H14 F7 N3 O4 S | YQIDQUCOJVSVSH-UHFFFAOYSA-N | InChI=1S/C20H14F7N3O4S/c1-3-10(35-18-19(32)34-29-30(18)8-4-6-9(33-2)7-5-8)17(31)28-16-14(23)12(21)11(20(25,26)27)13(22)15(16)24/h4-7,10H,3H2,1-2H3,(H-,28,29,31,32) | CCC(C(=O)Nc1c(c(c(c(c1F)F)C(F)(F)F)F)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250840 | 418.429 | C20 H14 N6 O3 S | XOLLQSVTOWXPMF-UHFFFAOYSA-N | InChI=1S/C20H14N6O3S/c21-8-13-16(11-6-7-11)14(9-22)19(24-18(13)23)30-10-15(27)17-20(28)29-25-26(17)12-4-2-1-3-5-12/h1-5,11H,6-7,10H2,(H2-,23,24,25,27,28) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(c(c(c(n3)N)C#N)C4CC4)C#N | |
| AKOS005250440 | 434.428 | C20 H14 N6 O4 S | IIWXTKFWSNMHCY-UHFFFAOYSA-N | InChI=1S/C20H14N6O4S/c1-29-12-8-6-11(7-9-12)26-17(19(28)30-25-26)15(27)10-31-20-22-18-16(23-24-20)13-4-2-3-5-14(13)21-18/h2-9H,10H2,1H3,(H-,21,22,23,24,25,27,28) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nc4c(c5ccccc5[nH]4)nn3 | |
| AKOS005253519 | 446.442 | C20 H14 N8 O3 S | YKMBWZBUMGYZPP-UHFFFAOYSA-N | InChI=1S/C20H14N8O3S/c1-28-15(20(30)31-27-28)12-10(7-21)17(23)26-19-13(12)14(22)16(32-19)18(29)25-9-2-3-11-8(6-9)4-5-24-11/h2-6,27H,1H3,(H5,22,23,26,29,30) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc5c(c4)cc[nH]5)N)N)C#N | |
| AKOS005253585 | 446.442 | C20 H14 N8 O3 S | IDQFMASAFCDZTI-UHFFFAOYSA-N | InChI=1S/C20H14N8O3S/c1-28-17(20(30)31-27-28)16-12(7-21)18(23)26-19(13(16)8-22)32-9-15(29)25-11-2-3-14-10(6-11)4-5-24-14/h2-6,27H,9H2,1H3,(H3,23,26,30) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc4c(c3)cc[nH]4)N)C#N | |
| AKOS005253266 | 448.352 | C20 H15 F3 N4 O5 | UUYGZHPLOWQCOC-UHFFFAOYSA-N | InChI=1S/C20H15F3N4O5/c21-20(22,23)31-14-8-6-12(7-9-14)26-17(28)10-15(18(26)29)24-11-16-19(30)32-25-27(16)13-4-2-1-3-5-13/h1-9,15,24H,10-11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)OC(F)(F)F | |
| AKOS005251168 | 377.416 | C20 H15 N3 O3 S | RKMUBDDZFGBQOL-UHFFFAOYSA-N | InChI=1S/C20H15N3O3S/c24-18(21-16-11-10-14-6-4-5-7-15(14)12-16)13-27-19-20(25)26-22-23(19)17-8-2-1-3-9-17/h1-12H,13H2,(H-,21,22,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc4ccccc4c3 | |
| AKOS005251175 | 377.416 | C20 H15 N3 O3 S | QDEFTJQEVCRJQI-UHFFFAOYSA-N | InChI=1S/C20H15N3O3S/c24-18(21-17-12-6-8-14-7-4-5-11-16(14)17)13-27-19-20(25)26-22-23(19)15-9-2-1-3-10-15/h1-12H,13H2,(H-,21,22,24,25) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cccc4c3cccc4 | |
| AKOS005250677 | 409.481 | C20 H15 N3 O3 S2 | YCJLMCSTFVUDSF-UHFFFAOYSA-N | InChI=1S/C20H15N3O3S2/c1-13-7-9-14(10-8-13)16-11-27-20(21-16)28-12-17(24)18-19(25)26-22-23(18)15-5-3-2-4-6-15/h2-11H,12H2,1H3 | Cc1ccc(cc1)c2csc(n2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250125 | 361.351 | C20 H15 N3 O4 | QSVPPLBDVDDWFO-UHFFFAOYSA-N | InChI=1S/C20H15N3O4/c1-26-17-10-8-16(9-11-17)23-18(20(25)27-22-23)19(24)21-15-7-6-13-4-2-3-5-14(13)12-15/h2-12H,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc4ccccc4c3 | |
| AKOS005250126 | 361.351 | C20 H15 N3 O4 | ZWJFBXRIJCERGN-UHFFFAOYSA-N | InChI=1S/C20H15N3O4/c1-26-15-11-9-14(10-12-15)23-18(20(25)27-22-23)19(24)21-17-8-4-6-13-5-2-3-7-16(13)17/h2-12H,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3cccc4c3cccc4 | |
| AKOS005250679 | 425.481 | C20 H15 N3 O4 S2 | FIPVMLZXPQXXJE-UHFFFAOYSA-N | InChI=1S/C20H15N3O4S2/c1-26-15-9-7-13(8-10-15)16-11-28-20(21-16)29-12-17(24)18-19(25)27-22-23(18)14-5-3-2-4-6-14/h2-11H,12H2,1H3 | COc1ccc(cc1)c2csc(n2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250782 | 425.481 | C20 H15 N3 O4 S2 | ZZPXKRHNKKSCGS-UHFFFAOYSA-N | InChI=1S/C20H15N3O4S2/c1-26-15-9-7-14(8-10-15)23-18(19(25)27-22-23)17(24)12-29-20-21-16(11-28-20)13-5-3-2-4-6-13/h2-11H,12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nc(cs3)c4ccccc4 | |
| AKOS005250719 | 405.43 | C20 H15 N5 O3 S | CCYLLOMZSVDKBG-UHFFFAOYSA-N | InChI=1S/C20H15N5O3S/c1-25-18(19(27)28-24-25)15(26)12-29-20-21-16(13-8-4-2-5-9-13)17(22-23-20)14-10-6-3-7-11-14/h2-11H,12H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2nc(c(nn2)c3ccccc3)c4ccccc4 | |
| AKOS005250716 | 421.429 | C20 H15 N5 O4 S | ITJADWMJJIEAIT-XNTDXEJSSA-N | InChI=1S/C20H15N5O4S/c1-24-17(19(28)29-23-24)16(26)12-30-20-22-15(10-13-6-5-9-21-11-13)18(27)25(20)14-7-3-2-4-8-14/h2-11H,12H2,1H3/b15-10+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3cccnc3)/C(=O)N2c4ccccc4 | |
| AKOS005250717 | 421.429 | C20 H15 N5 O4 S | HDPWAGANZLOCRC-RVDMUPIBSA-N | InChI=1S/C20H15N5O4S/c1-24-17(19(28)29-23-24)16(26)12-30-20-22-15(11-13-7-9-21-10-8-13)18(27)25(20)14-5-3-2-4-6-14/h2-11H,12H2,1H3/b15-11+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3ccncc3)/C(=O)N2c4ccccc4 | |
| AKOS005250746 | 421.429 | C20 H15 N5 O4 S | JOTVPMRXBMZHKB-RVDMUPIBSA-N | InChI=1S/C20H15N5O4S/c1-24-17(19(28)29-23-24)16(26)12-30-20-22-15(11-13-7-5-6-10-21-13)18(27)25(20)14-8-3-2-4-9-14/h2-11H,12H2,1H3/b15-11+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3ccccn3)/C(=O)N2c4ccccc4 | |
| AKOS005253544 | 449.443 | C20 H15 N7 O4 S | RPJGIKOKGZRFDV-UHFFFAOYSA-N | InChI=1S/C20H15N7O4S/c1-8(28)9-3-5-10(6-4-9)24-18(29)16-14(22)13-12(15-20(30)31-26-27(15)2)11(7-21)17(23)25-19(13)32-16/h3-6H,1-2H3,(H5-,22,23,24,25,26,28,29,30) | CC(=O)c1ccc(cc1)NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N | |
| AKOS005253668 | 449.443 | C20 H15 N7 O4 S | JDRZROYVNJYPFR-UHFFFAOYSA-N | InChI=1S/C20H15N7O4S/c1-10(28)11-3-5-12(6-4-11)24-15(29)9-32-19-14(8-22)16(13(7-21)18(23)25-19)17-20(30)31-26-27(17)2/h3-6H,9H2,1-2H3,(H3-,23,24,25,26,28,29,30) | CC(=O)c1ccc(cc1)NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253248 | 465.442 | C20 H15 N7 O5 S | GVBGFNGGZKUFIT-UHFFFAOYSA-N | InChI=1S/C20H15N7O5S/c1-9(17(28)24-11-5-3-10(4-6-11)19(29)30)33-18-13(8-22)14(12(7-21)16(23)25-18)15-20(31)32-26-27(15)2/h3-6,9H,1-2H3,(H4-,23,24,25,26,28,29,30,31) | CC(C(=O)Nc1ccc(cc1)C(=O)O)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253249 | 465.442 | C20 H15 N7 O5 S | MMAAUAMECNTJEC-UHFFFAOYSA-N | InChI=1S/C20H15N7O5S/c1-9(17(28)24-11-5-3-4-10(6-11)19(29)30)33-18-13(8-22)14(12(7-21)16(23)25-18)15-20(31)32-26-27(15)2/h3-6,9H,1-2H3,(H4-,23,24,25,26,28,29,30,31) | CC(C(=O)Nc1cccc(c1)C(=O)O)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253250 | 465.442 | C20 H15 N7 O5 S | SBCNYKLHWFDPMF-UHFFFAOYSA-N | InChI=1S/C20H15N7O5S/c1-9(18(28)24-10-3-4-13-14(5-10)31-8-30-13)33-19-12(7-22)15(11(6-21)17(23)25-19)16-20(29)32-26-27(16)2/h3-5,9H,8H2,1-2H3,(H3-,23,24,25,26,28,29) | CC(C(=O)Nc1ccc2c(c1)OCO2)Sc3c(c(c(c(n3)N)C#N)c4c(on[n+]4C)[O-])C#N | |
| AKOS005253435 | 465.442 | C20 H15 N7 O5 S | FTBUFOJTDKSUFU-UHFFFAOYSA-N | InChI=1S/C20H15N7O5S/c1-27-14(20(30)32-26-27)11-9(7-21)16(23)25-18-12(11)13(22)15(33-18)17(28)24-10-6-4-3-5-8(10)19(29)31-2/h3-6H,1-2H3,(H5-,22,23,24,25,26,28,29,30) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccccc4C(=O)OC)N)N)C#N | |
| AKOS005253480 | 465.442 | C20 H15 N7 O5 S | HOZFNDWLDOIFAM-UHFFFAOYSA-N | InChI=1S/C20H15N7O5S/c1-7-3-4-8(19(29)30)5-10(7)24-17(28)15-13(22)12-11(14-20(31)32-26-27(14)2)9(6-21)16(23)25-18(12)33-15/h3-5H,1-2H3,(H6-,22,23,24,25,26,28,29,30,31) | Cc1ccc(cc1NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N)C(=O)O | |
| AKOS005253496 | 465.442 | C20 H15 N7 O5 S | DUYQKLPHCYOGGI-UHFFFAOYSA-N | InChI=1S/C20H15N7O5S/c1-27-15(20(29)32-26-27)12-9(7-21)17(23)25-19-13(12)14(22)16(33-19)18(28)24-8-2-3-10-11(6-8)31-5-4-30-10/h2-3,6H,4-5H2,1H3,(H5-,22,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc5c(c4)OCCO5)N)N)C#N | |
| AKOS005253565 | 465.442 | C20 H15 N7 O5 S | TUFAGOSELDOSSH-UHFFFAOYSA-N | InChI=1S/C20H15N7O5S/c1-27-16(20(30)32-26-27)15-11(7-21)17(23)25-18(12(15)8-22)33-9-14(28)24-13-6-4-3-5-10(13)19(29)31-2/h3-6H,9H2,1-2H3,(H3-,23,24,25,26,28,29,30) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccccc3C(=O)OC)N)C#N | |
| AKOS005253616 | 465.442 | C20 H15 N7 O5 S | YJSDZIGCRLAEEI-UHFFFAOYSA-N | InChI=1S/C20H15N7O5S/c1-9-3-4-10(19(29)30)5-13(9)24-14(28)8-33-18-12(7-22)15(11(6-21)17(23)25-18)16-20(31)32-26-27(16)2/h3-5H,8H2,1-2H3,(H4-,23,24,25,26,28,29,30,31) | Cc1ccc(cc1NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N)C(=O)O | |
| AKOS005253631 | 465.442 | C20 H15 N7 O5 S | URYREZLKMXFKOC-UHFFFAOYSA-N | InChI=1S/C20H15N7O5S/c1-27-17(20(29)32-26-27)16-11(7-21)18(23)25-19(12(16)8-22)33-9-15(28)24-10-2-3-13-14(6-10)31-5-4-30-13/h2-3,6H,4-5,9H2,1H3,(H3-,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc4c(c3)OCCO4)N)C#N | |
| AKOS005253259 | 481.441 | C20 H15 N7 O6 S | KYIVWLPOVUPRJY-UHFFFAOYSA-N | InChI=1S/C20H15N7O6S/c1-8(17(29)24-9-3-4-13(28)10(5-9)19(30)31)34-18-12(7-22)14(11(6-21)16(23)25-18)15-20(32)33-26-27(15)2/h3-5,8,26H,1-2H3,(H4,23,25,30,31,32) | CC(C(=O)Nc1ccc(c(c1)C(=O)O)O)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253449 | 481.441 | C20 H15 N7 O6 S | JJVWCBZPOMDKIU-UHFFFAOYSA-N | InChI=1S/C20H15N7O6S/c1-27-14(20(31)33-26-27)11-8(6-21)16(23)25-18-12(11)13(22)15(34-18)17(28)24-9-4-3-7(19(29)30)5-10(9)32-2/h3-5H,1-2H3,(H6-,22,23,24,25,26,28,29,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(cc4OC)C(=O)O)N)N)C#N | |
| AKOS005253593 | 481.441 | C20 H15 N7 O6 S | LDDBEXTWQLHISA-UHFFFAOYSA-N | InChI=1S/C20H15N7O6S/c1-27-16(20(31)33-26-27)15-10(6-21)17(23)25-18(11(15)7-22)34-8-14(28)24-12-4-3-9(19(29)30)5-13(12)32-2/h3-5H,8H2,1-2H3,(H4-,23,24,25,26,28,29,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(cc3OC)C(=O)O)N)C#N | |
| AKOS005253220 | 469.904 | C20 H16 Cl N7 O3 S | ACZFQEJFKDTMNA-UHFFFAOYSA-N | InChI=1S/C20H16ClN7O3S/c1-9-13(21)5-4-6-14(9)25-18(29)10(2)32-19-12(8-23)15(11(7-22)17(24)26-19)16-20(30)31-27-28(16)3/h4-6,10H,1-3H3,(H3-,24,25,26,27,29,30) | Cc1c(cccc1Cl)NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253221 | 469.904 | C20 H16 Cl N7 O3 S | VCFUMWHQCDOAHR-UHFFFAOYSA-N | InChI=1S/C20H16ClN7O3S/c1-9-4-5-11(6-14(9)21)25-18(29)10(2)32-19-13(8-23)15(12(7-22)17(24)26-19)16-20(30)31-27-28(16)3/h4-6,10H,1-3H3,(H3-,24,25,26,27,29,30) | Cc1ccc(cc1Cl)NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253228 | 469.904 | C20 H16 Cl N7 O3 S | QIFGPKKFUYBZSE-UHFFFAOYSA-N | InChI=1S/C20H16ClN7O3S/c1-9-4-5-11(21)6-14(9)25-18(29)10(2)32-19-13(8-23)15(12(7-22)17(24)26-19)16-20(30)31-27-28(16)3/h4-6,10H,1-3H3,(H3-,24,25,26,27,29,30) | Cc1ccc(cc1NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N)Cl | |
| AKOS005253256 | 485.904 | C20 H16 Cl N7 O4 S | KYJDLEFQJZAHNN-UHFFFAOYSA-N | InChI=1S/C20H16ClN7O4S/c1-9(18(29)25-10-4-5-14(31-3)13(21)6-10)33-19-12(8-23)15(11(7-22)17(24)26-19)16-20(30)32-27-28(16)2/h4-6,9H,1-3H3,(H3-,24,25,26,27,29,30) | CC(C(=O)Nc1ccc(c(c1)Cl)OC)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253257 | 485.904 | C20 H16 Cl N7 O4 S | OJFPWNZYPPUGGF-UHFFFAOYSA-N | InChI=1S/C20H16ClN7O4S/c1-9(18(29)25-13-6-10(21)4-5-14(13)31-3)33-19-12(8-23)15(11(7-22)17(24)26-19)16-20(30)32-27-28(16)2/h4-6,9H,1-3H3,(H3-,24,25,26,27,29,30) | CC(C(=O)Nc1cc(ccc1OC)Cl)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253535 | 485.904 | C20 H16 Cl N7 O4 S | USDSQHCCBOZAMB-UHFFFAOYSA-N | InChI=1S/C20H16ClN7O4S/c1-7-4-10(11(31-3)5-9(7)21)25-18(29)16-14(23)13-12(15-20(30)32-27-28(15)2)8(6-22)17(24)26-19(13)33-16/h4-5H,1-3H3,(H5-,23,24,25,26,27,29,30) | Cc1cc(c(cc1Cl)OC)NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N | |
| AKOS005253659 | 485.904 | C20 H16 Cl N7 O4 S | WDRXNEKEHNNIIE-UHFFFAOYSA-N | InChI=1S/C20H16ClN7O4S/c1-9-4-13(14(31-3)5-12(9)21)25-15(29)8-33-19-11(7-23)16(10(6-22)18(24)26-19)17-20(30)32-27-28(17)2/h4-5H,8H2,1-3H3,(H3-,24,25,26,27,29,30) | Cc1cc(c(cc1Cl)OC)NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253425 | 501.903 | C20 H16 Cl N7 O5 S | QJCNHLXMBHPGEO-UHFFFAOYSA-N | InChI=1S/C20H16ClN7O5S/c1-28-15(20(30)33-27-28)12-7(6-22)17(24)26-19-13(12)14(23)16(34-19)18(29)25-9-4-8(21)10(31-2)5-11(9)32-3/h4-5H,1-3H3,(H5-,23,24,25,26,27,29,30) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4cc(c(cc4OC)OC)Cl)N)N)C#N | |
| AKOS005253551 | 501.903 | C20 H16 Cl N7 O5 S | XXNIOTWZMCFQRZ-UHFFFAOYSA-N | InChI=1S/C20H16ClN7O5S/c1-28-17(20(30)33-27-28)16-9(6-22)18(24)26-19(10(16)7-23)34-8-15(29)25-12-4-11(21)13(31-2)5-14(12)32-3/h4-5H,8H2,1-3H3,(H3-,24,25,26,27,29,30) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3cc(c(cc3OC)OC)Cl)N)C#N | |
| AKOS005252885 | 447.434 | C20 H16 F3 N5 O2 S | SNGXCHGGLQMAMV-UHFFFAOYSA-N | InChI=1S/C20H16F3N5O2S/c1-12(2)28-10-18(30-27-28)26-17(29)11-31-19-14(9-24)15(20(21,22)23)8-16(25-19)13-6-4-3-5-7-13/h3-8,10,12H,11H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)C(F)(F)F)C#N | |
| AKOS005252924 | 463.433 | C20 H16 F3 N5 O3 S | WHGTUIJHYSKRLA-UHFFFAOYSA-N | InChI=1S/C20H16F3N5O3S/c1-3-28-10-18(31-27-28)26-17(29)11-32-19-14(9-24)15(20(21,22)23)8-16(25-19)12-4-6-13(30-2)7-5-12/h4-8,10H,3,11H2,1-2H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccc(cc3)OC)C(F)(F)F)C#N | |
| AKOS005253296 | 463.433 | C20 H16 F3 N5 O3 S | DRMWIHYSBBEWRR-UHFFFAOYSA-N | InChI=1S/C20H16F3N5O3S/c1-30-8-7-28-11-18(31-27-28)26-17(29)12-32-19-14(10-24)15(20(21,22)23)9-16(25-19)13-5-3-2-4-6-13/h2-6,9,11H,7-8,12H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)C(F)(F)F)C#N | |
| AKOS005250711 | 392.431 | C20 H16 N4 O3 S | AZYHBSWNWWNRIU-UHFFFAOYSA-N | InChI=1S/C20H16N4O3S/c1-24-18(19(26)27-23-24)15(25)12-28-20-21-16(13-8-4-2-5-9-13)17(22-20)14-10-6-3-7-11-14/h2-11H,12H2,1H3,(H-,21,22,23,25,26) | C[n+]1c(c(on1)[O-])C(=O)CSc2[nH]c(c(n2)c3ccccc3)c4ccccc4 | |
| AKOS005250832 | 392.431 | C20 H16 N4 O3 S | DYVLBNJERGZFPZ-UHFFFAOYSA-N | InChI=1S/C20H16N4O3S/c21-11-14-10-13-6-4-5-9-16(13)22-19(14)28-12-17(25)18-20(26)27-23-24(18)15-7-2-1-3-8-15/h1-3,7-8,10H,4-6,9,12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(cc4c(n3)CCCC4)C#N | |
| AKOS005251774 | 392.431 | C20 H16 N4 O3 S | YBSJSQVWIQOSAB-UHFFFAOYSA-N | InChI=1S/C20H16N4O3S/c1-13(18(25)22-17-11-5-10-16-15(17)9-6-12-21-16)28-19-20(26)27-23-24(19)14-7-3-2-4-8-14/h2-13H,1H3,(H-,21,22,23,25,26) | CC(C(=O)Nc1cccc2c1cccn2)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252167 | 392.431 | C20 H16 N4 O3 S | NGMHBALLAKPLMT-UHFFFAOYSA-N | InChI=1S/C20H16N4O3S/c25-18(22-17-10-4-9-16-15(17)8-5-12-21-16)11-13-28-19-20(26)27-23-24(19)14-6-2-1-3-7-14/h1-10,12H,11,13H2,(H-,21,22,23,25,26) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cccc4c3cccn4 | |
| AKOS005253677 | 392.431 | C20 H16 N4 O3 S | JDYAQDLPWXDJQK-UHFFFAOYSA-N | InChI=1S/C20H16N4O3S/c1-11(2)10-12-8-9-14-15(21)18(28-19(14)22-12)17(25)16-20(26)27-23-24(16)13-6-4-3-5-7-13/h3-10H,1-2H3,(H2-,21,23,25,26) | CC(=Cc1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccccc4)[O-])N)C | |
| AKOS005253685 | 392.431 | C20 H16 N4 O3 S | SDUMSXQODASODK-UHFFFAOYSA-N | InChI=1S/C20H16N4O3S/c21-15-13-10-11-6-4-5-9-14(11)22-19(13)28-18(15)17(25)16-20(26)27-23-24(16)12-7-2-1-3-8-12/h1-3,7-8,10H,4-6,9H2,(H2-,21,23,25,26) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4cc5c(nc4s3)CCCC5)N | |
| AKOS005250456 | 408.43 | C20 H16 N4 O4 S | VLYRXSSCDZIXPR-UHFFFAOYSA-N | InChI=1S/C20H16N4O4S/c1-27-15-7-5-14(6-8-15)24-18(20(26)28-23-24)17(25)11-29-19-13(10-21)9-12-3-2-4-16(12)22-19/h5-9H,2-4,11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(cc4c(n3)CCC4)C#N | |
| AKOS005250804 | 408.43 | C20 H16 N4 O4 S | LHNHCGKJOPVTNT-UHFFFAOYSA-N | InChI=1S/C20H16N4O4S/c1-2-23-18(26)14-10-6-7-11-15(14)21-20(23)29-12-16(25)17-19(27)28-22-24(17)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3 | CCn1c(=O)c2ccccc2nc1SCC(=O)c3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251607 | 408.43 | C20 H16 N4 O4 S | WGODAPMOBKPPPG-UHFFFAOYSA-N | InChI=1S/C20H16N4O4S/c1-27-14-9-7-13(8-10-14)24-19(20(26)28-23-24)29-12-18(25)22-17-6-2-5-16-15(17)4-3-11-21-16/h2-11H,12H2,1H3,(H-,21,22,23,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cccc4c3cccn4 | |
| AKOS005253716 | 408.43 | C20 H16 N4 O4 S | LGQAFJGFFUPGEG-UHFFFAOYSA-N | InChI=1S/C20H16N4O4S/c1-27-12-7-5-11(6-8-12)24-16(20(26)28-23-24)17(25)18-15(21)13-9-10-3-2-4-14(10)22-19(13)29-18/h5-9H,2-4H2,1H3,(H2-,21,23,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4cc5c(nc4s3)CCC5)N | |
| AKOS005253856 | 408.43 | C20 H16 N4 O4 S | GAFLFMRQUOLRJA-UHFFFAOYSA-N | InChI=1S/C20H16N4O4S/c1-9-12(10(2)25)13(11-7-5-4-6-8-11)14-15(21)18(29-19(14)22-9)17(26)16-20(27)28-23-24(16)3/h4-8H,1-3H3,(H2-,21,23,26,27) | Cc1c(c(c2c(c(sc2n1)C(=O)c3c(on[n+]3C)[O-])N)c4ccccc4)C(=O)C | |
| AKOS005250428 | 424.43 | C20 H16 N4 O5 S | MREBBHJWQYWBSI-UHFFFAOYSA-N | InChI=1S/C20H16N4O5S/c1-23-18(26)14-5-3-4-6-15(14)21-20(23)30-11-16(25)17-19(27)29-22-24(17)12-7-9-13(28-2)10-8-12/h3-10H,11H2,1-2H3 | Cn1c(=O)c2ccccc2nc1SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005250827 | 424.43 | C20 H16 N4 O5 S | NUNUORUDTVRUTJ-UHFFFAOYSA-N | InChI=1S/C20H16N4O5S/c1-3-28-19(26)14-9-12(2)22-18(15(14)10-21)30-11-16(25)17-20(27)29-23-24(17)13-7-5-4-6-8-13/h4-9H,3,11H2,1-2H3 | CCOC(=O)c1cc(nc(c1C#N)SCC(=O)c2c(on[n+]2c3ccccc3)[O-])C | |
| AKOS005253698 | 424.43 | C20 H16 N4 O5 S | TZECCXQMXUGSII-UHFFFAOYSA-N | InChI=1S/C20H16N4O5S/c1-3-28-19(26)12-9-10(2)22-18-13(12)14(21)17(30-18)16(25)15-20(27)29-23-24(15)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3,(H2-,21,23,25,27) | CCOC(=O)c1cc(nc2c1c(c(s2)C(=O)c3c(on[n+]3c4ccccc4)[O-])N)C | |
| AKOS005252584 | 404.445 | C20 H16 N6 O2 S | KHHJZNWHCMWUCI-UHFFFAOYSA-N | InChI=1S/C20H16N6O2S/c1-26-12-17(28-25-26)21-16(27)13-29-20-22-18(14-8-4-2-5-9-14)19(23-24-20)15-10-6-3-7-11-15/h2-12H,13H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2nc(c(nn2)c3ccccc3)c4ccccc4 | |
| AKOS005252892 | 404.445 | C20 H16 N6 O2 S | JXOQIRZLFSKLHJ-UHFFFAOYSA-N | InChI=1S/C20H16N6O2S/c1-11(2)26-9-16(28-25-26)21-15(27)10-29-20-22-18-13-7-3-5-12-6-4-8-14(17(12)13)19(18)23-24-20/h3-9,11H,10H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nc-3c(nn2)-c4cccc5c4c3ccc5 | |
| AKOS005250697 | 420.444 | C20 H16 N6 O3 S | FGINDSZRHPRDSO-UHFFFAOYSA-N | InChI=1S/C20H16N6O3S/c1-3-11-4-6-12(7-5-11)16-13(8-21)18(23)24-19(14(16)9-22)30-10-15(27)17-20(28)29-25-26(17)2/h4-7H,3,10H2,1-2H3,(H2-,23,24,25,27,28) | CCc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)c3c(on[n+]3C)[O-])N)C#N | |
| AKOS005250824 | 420.444 | C20 H16 N6 O3 S | VDSACRANVOMRSQ-UHFFFAOYSA-N | InChI=1S/C20H16N6O3S/c1-11(2)16-13(8-21)18(23)24-19(14(16)9-22)30-10-15(27)17-20(28)29-25-26(17)12-6-4-3-5-7-12/h3-7,11H,10H2,1-2H3,(H2-,23,24,25,27,28) | CC(C)c1c(c(nc(c1C#N)SCC(=O)c2c(on[n+]2c3ccccc3)[O-])N)C#N | |
| AKOS005252495 | 420.444 | C20 H16 N6 O3 S | BHMRTYLIHCABAQ-LFIBNONCSA-N | InChI=1S/C20H16N6O3S/c1-25-12-18(29-24-25)23-17(27)13-30-20-22-16(11-14-7-5-6-10-21-14)19(28)26(20)15-8-3-2-4-9-15/h2-12H,13H2,1H3/b16-11+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccn3)/C(=O)N2c4ccccc4 | |
| AKOS005252502 | 420.444 | C20 H16 N6 O3 S | AUASAWGQDRLEQT-MHWRWJLKSA-N | InChI=1S/C20H16N6O3S/c1-25-12-18(29-24-25)23-17(27)13-30-20-22-16(10-14-6-5-9-21-11-14)19(28)26(20)15-7-3-2-4-8-15/h2-12H,13H2,1H3/b16-10+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccnc3)/C(=O)N2c4ccccc4 | |
| AKOS005252503 | 420.444 | C20 H16 N6 O3 S | NUTZCAMSYCBGBM-LFIBNONCSA-N | InChI=1S/C20H16N6O3S/c1-25-12-18(29-24-25)23-17(27)13-30-20-22-16(11-14-7-9-21-10-8-14)19(28)26(20)15-5-3-2-4-6-15/h2-12H,13H2,1H3/b16-11+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccncc3)/C(=O)N2c4ccccc4 | |
| AKOS005253395 | 420.444 | C20 H16 N6 O3 S | NYRKDWZSDICCRM-UHFFFAOYSA-N | InChI=1S/C20H16N6O3S/c1-28-9-8-26-10-16(29-25-26)21-15(27)11-30-20-22-18-13-6-2-4-12-5-3-7-14(17(12)13)19(18)23-24-20/h2-7,10H,8-9,11H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2nc-3c(nn2)-c4cccc5c4c3ccc5 | |
| AKOS005253797 | 420.444 | C20 H16 N6 O3 S | YBCQEAWMTYKBFG-UHFFFAOYSA-N | InChI=1S/C20H16N6O3S/c1-9(2)12-11(8-21)18(23)24-19-13(12)14(22)17(30-19)16(27)15-20(28)29-25-26(15)10-6-4-3-5-7-10/h3-7,9H,1-2H3,(H4-,22,23,24,25,27,28) | CC(C)c1c(c(nc2c1c(c(s2)C(=O)c3c(on[n+]3c4ccccc4)[O-])N)N)C#N | |
| AKOS005253234 | 464.457 | C20 H16 N8 O4 S | WJIIJXSKFDIRPE-UHFFFAOYSA-N | InChI=1S/C20H16N8O4S/c1-9(18(30)25-11-5-3-10(4-6-11)17(24)29)33-19-13(8-22)14(12(7-21)16(23)26-19)15-20(31)32-27-28(15)2/h3-6,9H,1-2H3,(H5-,23,24,25,26,27,29,30,31) | CC(C(=O)Nc1ccc(cc1)C(=O)N)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253235 | 464.457 | C20 H16 N8 O4 S | DMRAWCCVNMDTHM-UHFFFAOYSA-N | InChI=1S/C20H16N8O4S/c1-9(18(30)25-13-6-4-3-5-10(13)17(24)29)33-19-12(8-22)14(11(7-21)16(23)26-19)15-20(31)32-27-28(15)2/h3-6,9H,1-2H3,(H5-,23,24,25,26,27,29,30,31) | CC(C(=O)Nc1ccccc1C(=O)N)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253456 | 464.457 | C20 H16 N8 O4 S | HWNPPDZOIDPUOO-UHFFFAOYSA-N | InChI=1S/C20H16N8O4S/c1-8(29)24-9-3-5-10(6-4-9)25-18(30)16-14(22)13-12(15-20(31)32-27-28(15)2)11(7-21)17(23)26-19(13)33-16/h3-6,27H,1-2H3,(H5,22,23,26,30,31) | CC(=O)Nc1ccc(cc1)NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N | |
| AKOS005253592 | 464.457 | C20 H16 N8 O4 S | CGRFMPRKFLTJTO-UHFFFAOYSA-N | InChI=1S/C20H16N8O4S/c1-10(29)24-11-3-5-12(6-4-11)25-15(30)9-33-19-14(8-22)16(13(7-21)18(23)26-19)17-20(31)32-27-28(17)2/h3-6,27H,9H2,1-2H3,(H3,23,26,31) | CC(=O)Nc1ccc(cc1)NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253216 | 480.457 | C20 H16 N8 O5 S | NEMPLVDDEAVZQI-UHFFFAOYSA-N | InChI=1S/C20H16N8O5S/c1-9-6-11(28(31)32)4-5-14(9)24-18(29)10(2)34-19-13(8-22)15(12(7-21)17(23)25-19)16-20(30)33-26-27(16)3/h4-6,10H,1-3H3,(H3-,23,24,25,26,29,30) | Cc1cc(ccc1NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N)N(=O)=O | |
| AKOS005253217 | 480.457 | C20 H16 N8 O5 S | WQJYYUZEOCEVNK-UHFFFAOYSA-N | InChI=1S/C20H16N8O5S/c1-9-4-5-11(28(31)32)6-14(9)24-18(29)10(2)34-19-13(8-22)15(12(7-21)17(23)25-19)16-20(30)33-26-27(16)3/h4-6,10H,1-3H3,(H3-,23,24,25,26,29,30) | Cc1ccc(cc1NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N)N(=O)=O | |
| AKOS005251260 | 457.277 | C20 H17 Br N4 O4 | VAEZOLDSWQIZIH-UHFFFAOYSA-N | InChI=1S/C20H17BrN4O4/c1-23(12-17-20(28)29-22-25(17)15-5-3-2-4-6-15)16-11-18(26)24(19(16)27)14-9-7-13(21)8-10-14/h2-10,16H,11-12H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C3CC(=O)N(C3=O)c4ccc(cc4)Br | |
| AKOS005253181 | 473.277 | C20 H17 Br N4 O5 | WOZOHYADYQTTKX-UHFFFAOYSA-N | InChI=1S/C20H17BrN4O5/c1-29-15-8-6-14(7-9-15)25-17(20(28)30-23-25)11-22-16-10-18(26)24(19(16)27)13-4-2-12(21)3-5-13/h2-9,16,22H,10-11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)Br | |
| AKOS005252035 | 487.88 | C20 H17 Cl F3 N3 O4 S | WUVRGXDSXLVHOO-UHFFFAOYSA-N | InChI=1S/C20H17ClF3N3O4S/c1-3-16(17(28)25-15-9-4-11(21)10-14(15)20(22,23)24)32-18-19(29)31-26-27(18)12-5-7-13(30-2)8-6-12/h4-10,16H,3H2,1-2H3,(H-,25,26,28,29) | CCC(C(=O)Nc1ccc(cc1C(F)(F)F)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252038 | 487.88 | C20 H17 Cl F3 N3 O4 S | WVNZTGYEKFWICA-UHFFFAOYSA-N | InChI=1S/C20H17ClF3N3O4S/c1-3-16(17(28)25-15-10-11(20(22,23)24)4-9-14(15)21)32-18-19(29)31-26-27(18)12-5-7-13(30-2)8-6-12/h4-10,16H,3H2,1-2H3,(H-,25,26,28,29) | CCC(C(=O)Nc1cc(ccc1Cl)C(F)(F)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250936 | 412.826 | C20 H17 Cl N4 O4 | AKUYUAKBKNDLDA-UHFFFAOYSA-O | InChI=1S/C20H16ClN4O4/c1-25-17(20(28)29-24-25)11-16(23-18(26)13-7-3-2-4-8-13)19(27)22-12-14-9-5-6-10-15(14)21/h2-11H,12H2,1H3,(H,22,27)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCc2ccccc2Cl)\NC(=O)c3ccccc3 | |
| AKOS005251353 | 412.826 | C20 H17 Cl N4 O4 | XOCORHUSLALYDI-UHFFFAOYSA-N | InChI=1S/C20H17ClN4O4/c1-23(12-17-20(28)29-22-25(17)15-5-3-2-4-6-15)16-11-18(26)24(19(16)27)14-9-7-13(21)8-10-14/h2-10,16H,11-12H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C3CC(=O)N(C3=O)c4ccc(cc4)Cl | |
| AKOS005253180 | 428.826 | C20 H17 Cl N4 O5 | NRVZLGVFNQIIDE-UHFFFAOYSA-N | InChI=1S/C20H17ClN4O5/c1-29-15-8-6-14(7-9-15)25-17(20(28)30-23-25)11-22-16-10-18(26)24(19(16)27)13-4-2-12(21)3-5-13/h2-9,16,22H,10-11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)Cl | |
| AKOS005252999 | 456.905 | C20 H17 Cl N6 O3 S | RORXXUZCZUOZRG-UHFFFAOYSA-N | InChI=1S/C20H17ClN6O3S/c21-16-4-1-14(2-5-16)17-6-3-15(11-22)20(23-17)31-13-18(28)24-19-12-27(25-30-19)26-7-9-29-10-8-26/h1-6,12H,7-10,13H2 | c1cc(ccc1c2ccc(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)C#N)Cl | |
| AKOS005250289 | 434.273 | C20 H17 Cl2 N3 O4 | NQYSQEWQMWOCLY-UHFFFAOYSA-N | InChI=1S/C20H17Cl2N3O4/c1-28-15-7-5-14(6-8-15)25-18(20(27)29-23-25)11-24(13-3-4-13)19(26)16-9-2-12(21)10-17(16)22/h2,5-10,13H,3-4,11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4ccc(cc4Cl)Cl | |
| AKOS005250952 | 396.372 | C20 H17 F N4 O4 | FIIYDBANOJCHOW-UHFFFAOYSA-O | InChI=1S/C20H16FN4O4/c1-25-17(20(28)29-24-25)11-16(23-18(26)14-5-3-2-4-6-14)19(27)22-12-13-7-9-15(21)10-8-13/h2-11H,12H2,1H3,(H,22,27)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCc2ccc(cc2)F)\NC(=O)c3ccccc3 | |
| AKOS005251354 | 396.372 | C20 H17 F N4 O4 | FWBJWYICSGBPGK-UHFFFAOYSA-N | InChI=1S/C20H17FN4O4/c1-23(12-17-20(28)29-22-25(17)15-5-3-2-4-6-15)16-11-18(26)24(19(16)27)14-9-7-13(21)8-10-14/h2-10,16H,11-12H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C3CC(=O)N(C3=O)c4ccc(cc4)F | |
| AKOS005253183 | 412.371 | C20 H17 F N4 O5 | KLGPDGQHEFDMJA-UHFFFAOYSA-N | InChI=1S/C20H17FN4O5/c1-29-15-8-6-14(7-9-15)25-17(20(28)30-23-25)11-22-16-10-18(26)24(19(16)27)13-4-2-12(21)3-5-13/h2-9,16,22H,10-11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)F | |
| AKOS005253064 | 494.513 | C20 H17 F3 N6 O2 S2 | HVTGPVMTWBYBOA-UHFFFAOYSA-N | InChI=1S/C20H17F3N6O2S2/c21-20(22,23)14-9-15(16-5-4-8-32-16)25-19(13(14)10-24)33-12-17(30)26-18-11-29(27-31-18)28-6-2-1-3-7-28/h4-5,8-9,11H,1-3,6-7,12H2 | c1cc(sc1)c2cc(c(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)C#N)C(F)(F)F | |
| AKOS005252746 | 478.448 | C20 H17 F3 N6 O3 S | AGBYBCNHLAAEFH-UHFFFAOYSA-N | InChI=1S/C20H17F3N6O3S/c1-28(2)29-10-18(32-27-29)26-17(30)11-33-19-14(9-24)15(20(21,22)23)8-16(25-19)12-4-6-13(31-3)7-5-12/h4-8,10H,11H2,1-3H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccc(cc3)OC)C(F)(F)F)C#N | |
| AKOS005253182 | 520.277 | C20 H17 I N4 O5 | HZWGZKAQAHYGGL-UHFFFAOYSA-N | InChI=1S/C20H17IN4O5/c1-29-15-8-6-14(7-9-15)25-17(20(28)30-23-25)11-22-16-10-18(26)24(19(16)27)13-4-2-12(21)3-5-13/h2-9,16,22H,10-11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)I | |
| AKOS005252619 | 391.446 | C20 H17 N5 O2 S | JXBOPRPMYLXHAR-UHFFFAOYSA-N | InChI=1S/C20H17N5O2S/c1-25-12-17(27-24-25)21-16(26)13-28-20-22-18(14-8-4-2-5-9-14)19(23-20)15-10-6-3-7-11-15/h2-12H,13H2,1H3,(H-,21,22,23,24,26) | C[n+]1cc(on1)[N-]C(=O)CSc2[nH]c(c(n2)c3ccccc3)c4ccccc4 | |
| AKOS005252462 | 407.446 | C20 H17 N5 O3 S | CBYQSVHMHQWZSP-UHFFFAOYSA-N | InChI=1S/C20H17N5O3S/c1-2-24-12-18(28-23-24)22-17(26)13-29-20-21-16-11-7-6-10-15(16)19(27)25(20)14-8-4-3-5-9-14/h3-12H,2,13H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3c(=O)n2c4ccccc4 | |
| AKOS005252810 | 439.511 | C20 H17 N5 O3 S2 | XLPUTSFAABHICB-LFIBNONCSA-N | InChI=1S/C20H17N5O3S2/c1-2-24-12-18(28-23-24)22-17(26)13-30-20-21-16(11-15-9-6-10-29-15)19(27)25(20)14-7-4-3-5-8-14/h3-12H,2,13H2,1H3/b16-11+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccs3)/C(=O)N2c4ccccc4 | |
| AKOS005252930 | 423.445 | C20 H17 N5 O4 S | KMRORWPVLBZYCZ-LFIBNONCSA-N | InChI=1S/C20H17N5O4S/c1-2-24-12-18(29-23-24)22-17(26)13-30-20-21-16(11-15-9-6-10-28-15)19(27)25(20)14-7-4-3-5-8-14/h3-12H,2,13H2,1H3/b16-11+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccco3)/C(=O)N2c4ccccc4 | |
| AKOS005251597 | 455.51 | C20 H17 N5 O4 S2 | JJZPMWSXFPQUKT-UHFFFAOYSA-N | InChI=1S/C20H17N5O4S2/c1-12(26)24-8-7-14-15(9-21)18(31-16(14)10-24)22-17(27)11-30-19-20(28)29-23-25(19)13-5-3-2-4-6-13/h2-6H,7-8,10-11H2,1H3,(H-,22,23,27,28) | CC(=O)N1CCc2c(sc(c2C#N)NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005253276 | 407.379 | C20 H17 N5 O5 | NAQNWIYXVDYPLF-UHFFFAOYSA-N | InChI=1S/C20H17N5O5/c21-18(27)12-6-8-13(9-7-12)24-17(26)10-15(19(24)28)22-11-16-20(29)30-23-25(16)14-4-2-1-3-5-14/h1-9,15,22H,10-11H2,(H2-,21,23,27,29) | c1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)C(=O)N | |
| AKOS005250180 | 439.444 | C20 H17 N5 O5 S | FWGQSKYFYDKVPG-UHFFFAOYSA-N | InChI=1S/C20H17N5O5S/c1-11(26)24-8-7-14-15(9-21)19(31-16(14)10-24)22-18(27)17-20(28)30-23-25(17)12-3-5-13(29-2)6-4-12/h3-6H,7-8,10H2,1-2H3,(H-,22,23,27,28) | CC(=O)N1CCc2c(sc(c2C#N)NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005251294 | 423.379 | C20 H17 N5 O6 | IRSLEQHAHYGVIM-UHFFFAOYSA-N | InChI=1S/C20H17N5O6/c1-22(12-17-20(28)31-21-24(17)14-5-3-2-4-6-14)16-11-18(26)23(19(16)27)13-7-9-15(10-8-13)25(29)30/h2-10,16H,11-12H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C3CC(=O)N(C3=O)c4ccc(cc4)[N+](=O)[O-] | |
| AKOS005253171 | 439.378 | C20 H17 N5 O7 | GXOMDZOKEDWHLO-UHFFFAOYSA-N | InChI=1S/C20H17N5O7/c1-31-15-8-6-13(7-9-15)24-17(20(28)32-22-24)11-21-16-10-18(26)23(19(16)27)12-2-4-14(5-3-12)25(29)30/h2-9,16,21H,10-11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)N(=O)=O | |
| AKOS005252414 | 419.46 | C20 H17 N7 O2 S | AWJCLLLFMVJBQA-UHFFFAOYSA-N | InChI=1S/C20H17N7O2S/c1-3-12-4-6-13(7-5-12)18-14(8-21)19(23)25-20(15(18)9-22)30-11-16(28)24-17-10-27(2)26-29-17/h4-7,10H,3,11H2,1-2H3,(H2-,23,24,25,26,28) | CCc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)C)N)C#N | |
| AKOS005252465 | 419.46 | C20 H17 N7 O2 S | IJYIFNVOCCPTHE-UHFFFAOYSA-N | InChI=1S/C20H17N7O2S/c1-3-27-10-17(29-26-27)24-16(28)11-30-20-15(9-22)18(14(8-21)19(23)25-20)13-6-4-12(2)5-7-13/h4-7,10H,3,11H2,1-2H3,(H2-,23,24,25,26,28) | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3ccc(cc3)C)C#N | |
| AKOS005252870 | 419.46 | C20 H17 N7 O2 S | XNZYTLSLHZKLCP-UHFFFAOYSA-N | InChI=1S/C20H17N7O2S/c1-12(2)27-10-17(29-26-27)24-16(28)11-30-20-15(9-22)18(13-6-4-3-5-7-13)14(8-21)19(23)25-20/h3-7,10,12H,11H2,1-2H3,(H2-,23,24,25,26,28) | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3ccccc3)C#N | |
| AKOS005253198 | 435.459 | C20 H17 N7 O3 S | BXOCDGDNCZBOPU-UHFFFAOYSA-N | InChI=1S/C20H17N7O3S/c1-10-6-4-5-7-14(10)24-18(28)11(2)31-19-13(9-22)15(12(8-21)17(23)25-19)16-20(29)30-26-27(16)3/h4-7,11H,1-3H3,(H3-,23,24,25,26,28,29) | Cc1ccccc1NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253199 | 435.459 | C20 H17 N7 O3 S | PJQQHEFGUOTSLB-UHFFFAOYSA-N | InChI=1S/C20H17N7O3S/c1-10-5-4-6-12(7-10)24-18(28)11(2)31-19-14(9-22)15(13(8-21)17(23)25-19)16-20(29)30-26-27(16)3/h4-7,11H,1-3H3,(H3-,23,24,25,26,28,29) | Cc1cccc(c1)NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253206 | 435.459 | C20 H17 N7 O3 S | BDLHPHRWQXKFLV-UHFFFAOYSA-N | InChI=1S/C20H17N7O3S/c1-10-4-6-12(7-5-10)24-18(28)11(2)31-19-14(9-22)15(13(8-21)17(23)25-19)16-20(29)30-26-27(16)3/h4-7,11H,1-3H3,(H3-,23,24,25,26,28,29) | Cc1ccc(cc1)NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253417 | 435.459 | C20 H17 N7 O3 S | GADKGLHUMNCOOU-UHFFFAOYSA-N | InChI=1S/C20H17N7O3S/c1-29-8-7-27-11-17(30-26-27)24-16(28)12-31-20-15(10-22)18(13-5-3-2-4-6-13)14(9-21)19(23)25-20/h2-6,11H,7-8,12H2,1H3,(H2-,23,24,25,26,28) | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3ccccc3)C#N | |
| AKOS005253422 | 435.459 | C20 H17 N7 O3 S | HQYWRNJRVSDZKC-UHFFFAOYSA-N | InChI=1S/C20H17N7O3S/c1-8-5-4-6-11(9(8)2)24-18(28)16-14(22)13-12(15-20(29)30-26-27(15)3)10(7-21)17(23)25-19(13)31-16/h4-6H,1-3H3,(H5-,22,23,24,25,26,28,29) | Cc1cccc(c1C)NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N | |
| AKOS005253427 | 435.459 | C20 H17 N7 O3 S | KKJLKEBYRAJRRV-UHFFFAOYSA-N | InChI=1S/C20H17N7O3S/c1-8-5-4-6-9(2)14(8)24-18(28)16-13(22)12-11(15-20(29)30-26-27(15)3)10(7-21)17(23)25-19(12)31-16/h4-6H,1-3H3,(H5-,22,23,24,25,26,28,29) | Cc1cccc(c1NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N)C | |
| AKOS005253525 | 435.459 | C20 H17 N7 O3 S | QOPGGDIQPMKVGA-UHFFFAOYSA-N | InChI=1S/C20H17N7O3S/c1-8-4-5-11(9(2)6-8)24-18(28)16-14(22)13-12(15-20(29)30-26-27(15)3)10(7-21)17(23)25-19(13)31-16/h4-6H,1-3H3,(H5-,22,23,24,25,26,28,29) | Cc1ccc(c(c1)C)NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N | |
| AKOS005253526 | 435.459 | C20 H17 N7 O3 S | WFOWGQFXJWVOPX-UHFFFAOYSA-N | InChI=1S/C20H17N7O3S/c1-8-4-5-9(2)11(6-8)24-18(28)16-14(22)13-12(15-20(29)30-26-27(15)3)10(7-21)17(23)25-19(13)31-16/h4-6H,1-3H3,(H5-,22,23,24,25,26,28,29) | Cc1ccc(c(c1)NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N)C | |
| AKOS005253533 | 435.459 | C20 H17 N7 O3 S | PVDJOKSAOHTSAC-UHFFFAOYSA-N | InChI=1S/C20H17N7O3S/c1-8-4-5-10(6-9(8)2)24-18(28)16-14(22)13-12(15-20(29)30-26-27(15)3)11(7-21)17(23)25-19(13)31-16/h4-6H,1-3H3,(H5-,22,23,24,25,26,28,29) | Cc1ccc(cc1C)NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N | |
| AKOS005253534 | 435.459 | C20 H17 N7 O3 S | FSUDXSKEXIUOPK-UHFFFAOYSA-N | InChI=1S/C20H17N7O3S/c1-8-4-9(2)6-10(5-8)24-18(28)16-14(22)13-12(15-20(29)30-26-27(15)3)11(7-21)17(23)25-19(13)31-16/h4-6H,1-3H3,(H5-,22,23,24,25,26,28,29) | Cc1cc(cc(c1)NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N)C | |
| AKOS005253548 | 435.459 | C20 H17 N7 O3 S | PQJJHYOVFXBOJD-UHFFFAOYSA-N | InChI=1S/C20H17N7O3S/c1-10-5-4-6-14(11(10)2)24-15(28)9-31-19-13(8-22)16(12(7-21)18(23)25-19)17-20(29)30-26-27(17)3/h4-6H,9H2,1-3H3,(H3-,23,24,25,26,28,29) | Cc1cccc(c1C)NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253557 | 435.459 | C20 H17 N7 O3 S | RQURKOVNYLTNTB-UHFFFAOYSA-N | InChI=1S/C20H17N7O3S/c1-10-5-4-6-11(2)16(10)24-14(28)9-31-19-13(8-22)15(12(7-21)18(23)25-19)17-20(29)30-26-27(17)3/h4-6H,9H2,1-3H3,(H3-,23,24,25,26,28,29) | Cc1cccc(c1NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N)C | |
| AKOS005253649 | 435.459 | C20 H17 N7 O3 S | PGAFWZZGIXIZEK-UHFFFAOYSA-N | InChI=1S/C20H17N7O3S/c1-10-4-5-14(11(2)6-10)24-15(28)9-31-19-13(8-22)16(12(7-21)18(23)25-19)17-20(29)30-26-27(17)3/h4-6H,9H2,1-3H3,(H3-,23,24,25,26,28,29) | Cc1ccc(c(c1)C)NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253650 | 435.459 | C20 H17 N7 O3 S | RIJAZKSVJMWYPK-UHFFFAOYSA-N | InChI=1S/C20H17N7O3S/c1-10-4-5-11(2)14(6-10)24-15(28)9-31-19-13(8-22)16(12(7-21)18(23)25-19)17-20(29)30-26-27(17)3/h4-6H,9H2,1-3H3,(H3-,23,24,25,26,28,29) | Cc1ccc(c(c1)NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N)C | |
| AKOS005253657 | 435.459 | C20 H17 N7 O3 S | SPDKRQLRQXPQSI-UHFFFAOYSA-N | InChI=1S/C20H17N7O3S/c1-10-4-5-12(6-11(10)2)24-15(28)9-31-19-14(8-22)16(13(7-21)18(23)25-19)17-20(29)30-26-27(17)3/h4-6H,9H2,1-3H3,(H3-,23,24,25,26,28,29) | Cc1ccc(cc1C)NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253658 | 435.459 | C20 H17 N7 O3 S | GTBLYEMHABZJID-UHFFFAOYSA-N | InChI=1S/C20H17N7O3S/c1-10-4-11(2)6-12(5-10)24-15(28)9-31-19-14(8-22)16(13(7-21)18(23)25-19)17-20(29)30-26-27(17)3/h4-6H,9H2,1-3H3,(H3-,23,24,25,26,28,29) | Cc1cc(cc(c1)NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N)C | |
| AKOS005253193 | 451.458 | C20 H17 N7 O4 S | QOROPSUCTMQYED-UHFFFAOYSA-N | InChI=1S/C20H17N7O4S/c1-10(18(28)24-11-4-6-12(30-3)7-5-11)32-19-14(9-22)15(13(8-21)17(23)25-19)16-20(29)31-26-27(16)2/h4-7,10H,1-3H3,(H3-,23,24,25,26,28,29) | CC(C(=O)Nc1ccc(cc1)OC)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253262 | 451.458 | C20 H17 N7 O4 S | QZORBTCXAAMAJM-UHFFFAOYSA-N | InChI=1S/C20H17N7O4S/c1-10(18(28)24-13-6-4-5-7-14(13)30-3)32-19-12(9-22)15(11(8-21)17(23)25-19)16-20(29)31-26-27(16)2/h4-7,10H,1-3H3,(H3-,23,24,25,26,28,29) | CC(C(=O)Nc1ccccc1OC)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253263 | 451.458 | C20 H17 N7 O4 S | ODUIIFMHCOWJNQ-UHFFFAOYSA-N | InChI=1S/C20H17N7O4S/c1-10(18(28)24-11-5-4-6-12(7-11)30-3)32-19-14(9-22)15(13(8-21)17(23)25-19)16-20(29)31-26-27(16)2/h4-7,10H,1-3H3,(H3-,23,24,25,26,28,29) | CC(C(=O)Nc1cccc(c1)OC)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253438 | 451.458 | C20 H17 N7 O4 S | LMGAPLFRHKPHAB-UHFFFAOYSA-N | InChI=1S/C20H17N7O4S/c1-3-30-11-7-5-4-6-10(11)24-18(28)16-14(22)13-12(15-20(29)31-26-27(15)2)9(8-21)17(23)25-19(13)32-16/h4-7H,3H2,1-2H3,(H5-,22,23,24,25,26,28,29) | CCOc1ccccc1NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N | |
| AKOS005253439 | 451.458 | C20 H17 N7 O4 S | QWIZPPASNUMGAJ-UHFFFAOYSA-N | InChI=1S/C20H17N7O4S/c1-3-30-10-6-4-9(5-7-10)24-18(28)16-14(22)13-12(15-20(29)31-26-27(15)2)11(8-21)17(23)25-19(13)32-16/h4-7H,3H2,1-2H3,(H5-,22,23,24,25,26,28,29) | CCOc1ccc(cc1)NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N | |
| AKOS005253568 | 451.458 | C20 H17 N7 O4 S | REHSVUIKWKRKCL-UHFFFAOYSA-N | InChI=1S/C20H17N7O4S/c1-3-30-14-7-5-4-6-13(14)24-15(28)10-32-19-12(9-22)16(11(8-21)18(23)25-19)17-20(29)31-26-27(17)2/h4-7H,3,10H2,1-2H3,(H3-,23,24,25,26,28,29) | CCOc1ccccc1NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253569 | 451.458 | C20 H17 N7 O4 S | CFEDROMSJBEEEF-UHFFFAOYSA-N | InChI=1S/C20H17N7O4S/c1-3-30-12-6-4-11(5-7-12)24-15(28)10-32-19-14(9-22)16(13(8-21)18(23)25-19)17-20(29)31-26-27(17)2/h4-7H,3,10H2,1-2H3,(H3-,23,24,25,26,28,29) | CCOc1ccc(cc1)NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253530 | 467.458 | C20 H17 N7 O5 S | OTGKCWPDNHJYCN-UHFFFAOYSA-N | InChI=1S/C20H17N7O5S/c1-27-15(20(29)32-26-27)12-9(7-21)17(23)25-19-13(12)14(22)16(33-19)18(28)24-10-5-4-8(30-2)6-11(10)31-3/h4-6H,1-3H3,(H5-,22,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(cc4OC)OC)N)N)C#N | |
| AKOS005253537 | 467.458 | C20 H17 N7 O5 S | RIGCMEDQWJRUML-UHFFFAOYSA-N | InChI=1S/C20H17N7O5S/c1-27-15(20(29)32-26-27)12-9(7-21)17(23)25-19-13(12)14(22)16(33-19)18(28)24-10-6-8(30-2)4-5-11(10)31-3/h4-6H,1-3H3,(H5-,22,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4cc(ccc4OC)OC)N)N)C#N | |
| AKOS005253538 | 467.458 | C20 H17 N7 O5 S | RCLQMKNTBXBCRK-UHFFFAOYSA-N | InChI=1S/C20H17N7O5S/c1-27-15(20(29)32-26-27)12-11(7-21)17(23)25-19-13(12)14(22)16(33-19)18(28)24-8-4-9(30-2)6-10(5-8)31-3/h4-6H,1-3H3,(H5-,22,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4cc(cc(c4)OC)OC)N)N)C#N | |
| AKOS005253554 | 467.458 | C20 H17 N7 O5 S | PUGGNCKHMVGCAW-UHFFFAOYSA-N | InChI=1S/C20H17N7O5S/c1-27-17(20(29)32-26-27)16-11(7-21)18(23)25-19(12(16)8-22)33-9-15(28)24-13-5-4-10(30-2)6-14(13)31-3/h4-6H,9H2,1-3H3,(H3-,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(cc3OC)OC)N)C#N | |
| AKOS005253555 | 467.458 | C20 H17 N7 O5 S | ZMJVVGHUBOTCFQ-UHFFFAOYSA-N | InChI=1S/C20H17N7O5S/c1-27-17(20(29)32-26-27)16-11(7-21)18(23)25-19(12(16)8-22)33-9-15(28)24-13-6-10(30-2)4-5-14(13)31-3/h4-6H,9H2,1-3H3,(H3-,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3cc(ccc3OC)OC)N)C#N | |
| AKOS005253556 | 467.458 | C20 H17 N7 O5 S | LJNPMYYMHWUBPM-UHFFFAOYSA-N | InChI=1S/C20H17N7O5S/c1-27-17(20(29)32-26-27)16-13(7-21)18(23)25-19(14(16)8-22)33-9-15(28)24-10-4-11(30-2)6-12(5-10)31-3/h4-6H,9H2,1-3H3,(H3-,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3cc(cc(c3)OC)OC)N)C#N | |
| AKOS005219491 | 383.828 | C20 H18 Cl N3 O3 | STQOIPYSULYTIG-UHFFFAOYSA-N | InChI=1S/C20H18ClN3O3/c21-15-8-6-14(7-9-15)12-19(25)23(16-10-11-16)13-18-20(26)27-22-24(18)17-4-2-1-3-5-17/h1-9,16H,10-13H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)Cc4ccc(cc4)Cl | |
| AKOS005250328 | 399.828 | C20 H18 Cl N3 O4 | FKRKPANEQHFOFP-UHFFFAOYSA-N | InChI=1S/C20H18ClN3O4/c1-27-17-9-7-16(8-10-17)24-18(20(26)28-22-24)12-23(15-5-6-15)19(25)13-3-2-4-14(21)11-13/h2-4,7-11,15H,5-6,12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4cccc(c4)Cl | |
| AKOS005251992 | 463.891 | C20 H18 Cl N3 O6 S | YYVBMUFYDLKYNM-UHFFFAOYSA-N | InChI=1S/C20H18ClN3O6S/c1-3-16(17(25)22-11-4-9-15(21)14(10-11)19(26)27)31-18-20(28)30-23-24(18)12-5-7-13(29-2)8-6-12/h4-10,16H,3H2,1-2H3,(H2-,22,23,25,26,27,28) | CCC(C(=O)Nc1ccc(c(c1)C(=O)O)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252007 | 463.891 | C20 H18 Cl N3 O6 S | PSJKXCKVOQTBNP-UHFFFAOYSA-N | InChI=1S/C20H18ClN3O6S/c1-3-16(17(25)22-15-10-11(19(26)27)4-9-14(15)21)31-18-20(28)30-23-24(18)12-5-7-13(29-2)8-6-12/h4-10,16H,3H2,1-2H3,(H2-,22,23,25,26,27,28) | CCC(C(=O)Nc1cc(ccc1Cl)C(=O)O)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250313 | 383.373 | C20 H18 F N3 O4 | MLDHHIQLFOFSJA-UHFFFAOYSA-N | InChI=1S/C20H18FN3O4/c1-27-15-10-8-14(9-11-15)24-18(20(26)28-22-24)12-23(13-6-7-13)19(25)16-4-2-3-5-17(16)21/h2-5,8-11,13H,6-7,12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4ccccc4F | |
| AKOS005250320 | 383.373 | C20 H18 F N3 O4 | YQSNASDLTHSHTQ-UHFFFAOYSA-N | InChI=1S/C20H18FN3O4/c1-27-17-10-8-16(9-11-17)24-18(20(26)28-22-24)12-23(15-6-7-15)19(25)13-2-4-14(21)5-3-13/h2-5,8-11,15H,6-7,12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4ccc(cc4)F | |
| AKOS005215327 | 405.37 | C20 H18 F3 N3 O3 | DGTRGZCVSSEAKE-UHFFFAOYSA-N | InChI=1S/C20H18F3N3O3/c1-12(2)26-16(17(27)13-8-10-15(11-9-13)20(21,22)23)19(29-25-26)24-18(28)14-6-4-3-5-7-14/h3-12,17,27H,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)C(c3ccc(cc3)C(F)(F)F)O | |
| AKOS005251708 | 453.435 | C20 H18 F3 N3 O4 S | BNXFFCJQNKMPON-UHFFFAOYSA-N | InChI=1S/C20H18F3N3O4S/c1-3-16(17(27)24-15-7-5-4-6-14(15)20(21,22)23)31-18-19(28)30-25-26(18)12-8-10-13(29-2)11-9-12/h4-11,16H,3H2,1-2H3,(H-,24,25,27,28) | CCC(C(=O)Nc1ccccc1C(F)(F)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251717 | 453.435 | C20 H18 F3 N3 O4 S | BTDSOTVPBQDXET-UHFFFAOYSA-N | InChI=1S/C20H18F3N3O4S/c1-3-16(17(27)24-13-6-4-5-12(11-13)20(21,22)23)31-18-19(28)30-25-26(18)14-7-9-15(29-2)10-8-14/h4-11,16H,3H2,1-2H3,(H-,24,25,27,28) | CCC(C(=O)Nc1cccc(c1)C(F)(F)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251951 | 469.434 | C20 H18 F3 N3 O5 S | SLQNZJZYDLNPNP-UHFFFAOYSA-N | InChI=1S/C20H18F3N3O5S/c1-3-16(17(27)24-12-4-8-15(9-5-12)30-20(21,22)23)32-18-19(28)31-25-26(18)13-6-10-14(29-2)11-7-13/h4-11,16H,3H2,1-2H3,(H-,24,25,27,28) | CCC(C(=O)Nc1ccc(cc1)OC(F)(F)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251964 | 469.434 | C20 H18 F3 N3 O5 S | AKZDFADNJABNIY-UHFFFAOYSA-N | InChI=1S/C20H18F3N3O5S/c1-3-16(17(27)24-14-6-4-5-7-15(14)30-20(21,22)23)32-18-19(28)31-25-26(18)12-8-10-13(29-2)11-9-12/h4-11,16H,3H2,1-2H3,(H-,24,25,27,28) | CCC(C(=O)Nc1ccccc1OC(F)(F)F)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005219512 | 394.447 | C20 H18 N4 O3 S | PTRXAAZGCWBNFG-UHFFFAOYSA-N | InChI=1S/C20H18N4O3S/c1-13(2)10-15-9-8-14(11-21)19(22-15)28-12-17(25)18-20(26)27-23-24(18)16-6-4-3-5-7-16/h3-9,13H,10,12H2,1-2H3 | CC(C)Cc1ccc(c(n1)SCC(=O)c2c(on[n+]2c3ccccc3)[O-])C#N | |
| AKOS005250838 | 394.447 | C20 H18 N4 O3 S | XTKLXTZOSXBKNX-UHFFFAOYSA-N | InChI=1S/C20H18N4O3S/c1-2-3-7-15-11-10-14(12-21)19(22-15)28-13-17(25)18-20(26)27-23-24(18)16-8-5-4-6-9-16/h4-6,8-11H,2-3,7,13H2,1H3 | CCCCc1ccc(c(n1)SCC(=O)c2c(on[n+]2c3ccccc3)[O-])C#N | |
| AKOS005251360 | 394.447 | C20 H18 N4 O3 S | OOLSKTBSXAXOGW-UHFFFAOYSA-N | InChI=1S/C20H18N4O3S/c1-22-16(19(25)27-21-22)12-23(13-10-11-13)20(26)24-14-6-2-4-8-17(14)28-18-9-5-3-7-15(18)24/h2-9,13H,10-12H2,1H3 | C[n+]1c(c(on1)[O-])CN(C2CC2)C(=O)N3c4ccccc4Sc5c3cccc5 | |
| AKOS005251980 | 394.447 | C20 H18 N4 O3 S | AUDYNTHZPIOUOE-UHFFFAOYSA-N | InChI=1S/C20H18N4O3S/c1-2-17(18(25)22-14-8-9-16-13(12-14)10-11-21-16)28-19-20(26)27-23-24(19)15-6-4-3-5-7-15/h3-12,17,23,26H,2H2,1H3 | CCC(C(=O)Nc1ccc2c(c1)cc[nH]2)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005253682 | 394.447 | C20 H18 N4 O3 S | LQEVVQBDMBOYCB-UHFFFAOYSA-N | InChI=1S/C20H18N4O3S/c1-2-3-7-12-10-11-14-15(21)18(28-19(14)22-12)17(25)16-20(26)27-23-24(16)13-8-5-4-6-9-13/h4-6,8-11H,2-3,7H2,1H3,(H2-,21,23,25,26) | CCCCc1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccccc4)[O-])N | |
| AKOS005253738 | 394.447 | C20 H18 N4 O3 S | CIVLUAPXJGXUNK-UHFFFAOYSA-N | InChI=1S/C20H18N4O3S/c1-4-13-10(2)14-15(21)18(28-19(14)22-11(13)3)17(25)16-20(26)27-23-24(16)12-8-6-5-7-9-12/h5-9H,4H2,1-3H3,(H2-,21,23,25,26) | CCc1c(c2c(c(sc2nc1C)C(=O)c3c(on[n+]3c4ccccc4)[O-])N)C | |
| AKOS005253802 | 394.447 | C20 H18 N4 O3 S | FCZDTXKIFYYEHS-UHFFFAOYSA-N | InChI=1S/C20H18N4O3S/c1-11(2)10-12-8-9-14-15(21)18(28-19(14)22-12)17(25)16-20(26)27-23-24(16)13-6-4-3-5-7-13/h3-9,11H,10H2,1-2H3,(H2-,21,23,25,26) | CC(C)Cc1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccccc4)[O-])N | |
| AKOS005251561 | 426.512 | C20 H18 N4 O3 S2 | QSELTPSBIVZCKI-UHFFFAOYSA-N | InChI=1S/C20H18N4O3S2/c1-24-19(20(26)27-23-24)28-11-17(25)22-18-15(10-21)14-8-7-13(9-16(14)29-18)12-5-3-2-4-6-12/h2-6,13H,7-9,11H2,1H3,(H-,22,23,25,26) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2c(c3c(s2)CC(CC3)c4ccccc4)C#N | |
| AKOS005251602 | 426.512 | C20 H18 N4 O3 S2 | SHRSKMIHFOHNTC-UHFFFAOYSA-N | InChI=1S/C20H18N4O3S2/c1-12-7-8-14-15(10-21)18(29-16(14)9-12)22-17(25)11-28-19-20(26)27-23-24(19)13-5-3-2-4-6-13/h2-6,12H,7-9,11H2,1H3,(H-,22,23,25,26) | CC1CCc2c(sc(c2C#N)NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005251754 | 426.512 | C20 H18 N4 O3 S2 | NOJZWCPLYHCJFW-UHFFFAOYSA-N | InChI=1S/C20H18N4O3S2/c1-12(28-19-20(26)27-23-24(19)13-7-3-2-4-8-13)17(25)22-18-15(11-21)14-9-5-6-10-16(14)29-18/h2-4,7-8,12H,5-6,9-10H2,1H3,(H-,22,23,25,26) | CC(C(=O)Nc1c(c2c(s1)CCCC2)C#N)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252544 | 426.512 | C20 H18 N4 O3 S2 | CTXDJPKNMDLMPM-UHFFFAOYSA-N | InChI=1S/C20H18N4O3S2/c21-12-15-14-8-4-5-9-16(14)29-18(15)22-17(25)10-11-28-19-20(26)27-23-24(19)13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-11H2,(H-,22,23,25,26) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3c(c4c(s3)CCCC4)C#N | |
| AKOS005219816 | 378.381 | C20 H18 N4 O4 | WLEFSAKTABLTKJ-UHFFFAOYSA-N | InChI=1S/C20H18N4O4/c1-20(2)8-13(25)16-14(9-20)27-18(22)12(10-21)15(16)17-19(26)28-23-24(17)11-6-4-3-5-7-11/h3-7,15H,8-9,22H2,1-2H3 | CC1(CC2=C(C(C(=C(O2)N)C#N)c3c(on[n+]3c4ccccc4)[O-])C(=O)C1)C | |
| AKOS005250197 | 378.381 | C20 H18 N4 O4 | ZLMFQSHSMXSYHQ-UHFFFAOYSA-N | InChI=1S/C20H18N4O4/c1-27-15-8-6-14(7-9-15)24-18(20(26)28-23-24)19(25)21-11-10-13-12-22-17-5-3-2-4-16(13)17/h2-9,12,22H,10-11H2,1H3,(H-,21,23,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCCc3c[nH]c4c3cccc4 | |
| AKOS005250493 | 378.381 | C20 H18 N4 O4 | JQTWUMYRLOZDAQ-UHFFFAOYSA-N | InChI=1S/C20H18N4O4/c25-17-8-4-7-16-14-9-13(11-23(16)17)10-22(12-14)19(26)18-20(27)28-21-24(18)15-5-2-1-3-6-15/h1-8,13-14H,9-12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CC4CC(C3)c5cccc(=O)n5C4 | |
| AKOS005250961 | 378.381 | C20 H18 N4 O4 | QEHGEQIWYDJTHT-UHFFFAOYSA-O | InChI=1S/C20H17N4O4/c1-24-17(20(27)28-23-24)12-16(22-18(25)15-10-6-3-7-11-15)19(26)21-13-14-8-4-2-5-9-14/h2-12H,13H2,1H3,(H,21,26)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCc2ccccc2)\NC(=O)c3ccccc3 | |
| AKOS005251345 | 378.381 | C20 H18 N4 O4 | OKNGIRYVIIRKQM-UHFFFAOYSA-N | InChI=1S/C20H18N4O4/c1-22(13-17-20(27)28-21-24(17)15-10-6-3-7-11-15)16-12-18(25)23(19(16)26)14-8-4-2-5-9-14/h2-11,16H,12-13H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C3CC(=O)N(C3=O)c4ccccc4 | |
| AKOS005253164 | 378.381 | C20 H18 N4 O4 | LORRSALTJCMYCF-UHFFFAOYSA-N | InChI=1S/C20H18N4O4/c1-13-7-9-14(10-8-13)23-18(25)11-16(19(23)26)21-12-17-20(27)28-22-24(17)15-5-3-2-4-6-15/h2-10,16,21H,11-12H2,1H3 | Cc1ccc(cc1)N2C(=O)CC(C2=O)NCc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250185 | 410.446 | C20 H18 N4 O4 S | QGSCTMJYQZRPNT-UHFFFAOYSA-N | InChI=1S/C20H18N4O4S/c1-11-3-8-14-15(10-21)19(29-16(14)9-11)22-18(25)17-20(26)28-23-24(17)12-4-6-13(27-2)7-5-12/h4-7,11H,3,8-9H2,1-2H3,(H-,22,23,25,26) | CC1CCc2c(sc(c2C#N)NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005250415 | 410.446 | C20 H18 N4 O4 S | RCUIGELGFVBJPV-UHFFFAOYSA-N | InChI=1S/C20H18N4O4S/c1-11-12(2)16(9-21)19(22-13(11)3)29-10-17(25)18-20(26)28-23-24(18)14-5-7-15(27-4)8-6-14/h5-8H,10H2,1-4H3 | Cc1c(c(c(nc1C)SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C#N)C | |
| AKOS005250451 | 410.446 | C20 H18 N4 O4 S | LYJHUVMXOSIHFT-UHFFFAOYSA-N | InChI=1S/C20H18N4O4S/c1-12(2)16-9-4-13(10-21)19(22-16)29-11-17(25)18-20(26)28-23-24(18)14-5-7-15(27-3)8-6-14/h4-9,12H,11H2,1-3H3 | CC(C)c1ccc(c(n1)SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C#N | |
| AKOS005250458 | 410.446 | C20 H18 N4 O4 S | NYXJHHKUYWVZDI-UHFFFAOYSA-N | InChI=1S/C20H18N4O4S/c1-3-4-14-6-5-13(11-21)19(22-14)29-12-17(25)18-20(26)28-23-24(18)15-7-9-16(27-2)10-8-15/h5-10H,3-4,12H2,1-2H3 | CCCc1ccc(c(n1)SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C#N | |
| AKOS005251865 | 410.446 | C20 H18 N4 O4 S | ATQVYXBCLLOGNL-UHFFFAOYSA-N | InChI=1S/C20H18N4O4S/c1-12(18(25)22-14-3-8-17-13(11-14)9-10-21-17)29-19-20(26)28-23-24(19)15-4-6-16(27-2)7-5-15/h3-12,23,26H,1-2H3 | CC(C(=O)Nc1ccc2c(c1)cc[nH]2)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005251911 | 410.446 | C20 H18 N4 O4 S | BMZIHOINZKUPPW-UHFFFAOYSA-N | InChI=1S/C20H18N4O4S/c1-3-16(29-19-20(26)28-23-24(19)2)17(25)21-13-10-8-12(9-11-13)18-22-14-6-4-5-7-15(14)27-18/h4-11,16H,3H2,1-2H3,(H-,21,22,23,25,26) | CCC(C(=O)Nc1ccc(cc1)c2nc3ccccc3o2)Sc4c(on[n+]4C)[O-] | |
| AKOS005252642 | 410.446 | C20 H18 N4 O4 S | POGGZIJMCPOGQM-UHFFFAOYSA-N | InChI=1S/C20H18N4O4S/c1-27-16-5-3-15(4-6-16)24-19(20(26)28-23-24)29-11-9-18(25)22-14-2-7-17-13(12-14)8-10-21-17/h2-8,10,12,23,26H,9,11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc4c(c3)cc[nH]4 | |
| AKOS005253707 | 410.446 | C20 H18 N4 O4 S | ATWKHQIVWVCODW-UHFFFAOYSA-N | InChI=1S/C20H18N4O4S/c1-3-4-11-5-10-14-15(21)18(29-19(14)22-11)17(25)16-20(26)28-23-24(16)12-6-8-13(27-2)9-7-12/h5-10H,3-4H2,1-2H3,(H2-,21,23,25,26) | CCCc1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N | |
| AKOS005253768 | 410.446 | C20 H18 N4 O4 S | NANXKSKRAUTOHU-UHFFFAOYSA-N | InChI=1S/C20H18N4O4S/c1-10(2)14-9-8-13-15(21)18(29-19(13)22-14)17(25)16-20(26)28-23-24(16)11-4-6-12(27-3)7-5-11/h4-10H,1-3H3,(H2-,21,23,25,26) | CC(C)c1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N | |
| AKOS005254180 | 410.446 | C20 H18 N4 O4 S | SUNLGNUUGHYYSY-UHFFFAOYSA-N | InChI=1S/C20H18N4O4S/c1-9-10(2)14-15(21)18(29-19(14)22-11(9)3)17(25)16-20(26)28-23-24(16)12-5-7-13(27-4)8-6-12/h5-8H,1-4H3,(H2-,21,23,25,26) | Cc1c(c2c(c(sc2nc1C)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N)C | |
| AKOS005251508 | 442.511 | C20 H18 N4 O4 S2 | OZGQYQMVHIQRKN-UHFFFAOYSA-N | InChI=1S/C20H18N4O4S2/c1-27-13-8-6-12(7-9-13)24-19(20(26)28-23-24)29-11-17(25)22-18-15(10-21)14-4-2-3-5-16(14)30-18/h6-9H,2-5,11H2,1H3,(H-,22,23,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3c(c4c(s3)CCCC4)C#N | |
| AKOS005251032 | 394.381 | C20 H18 N4 O5 | KYYFYBAVOWXVJB-UHFFFAOYSA-O | InChI=1S/C20H17N4O5/c25-12-11-21-19(27)16(22-18(26)14-7-3-1-4-8-14)13-17-20(28)29-23-24(17)15-9-5-2-6-10-15/h1-10,13,25H,11-12H2,(H,21,27)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCCO | |
| AKOS005253165 | 394.381 | C20 H18 N4 O5 | XSCCHCBZTQWWEA-UHFFFAOYSA-N | InChI=1S/C20H18N4O5/c1-28-15-9-7-13(8-10-15)23-18(25)11-16(19(23)26)21-12-17-20(27)29-22-24(17)14-5-3-2-4-6-14/h2-10,16,21H,11-12H2,1H3 | COc1ccc(cc1)N2C(=O)CC(C2=O)NCc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005253270 | 394.381 | C20 H18 N4 O5 | OHPOHLDJCKEARI-UHFFFAOYSA-N | InChI=1S/C20H18N4O5/c1-28-15-9-7-14(8-10-15)24-17(20(27)29-22-24)12-21-16-11-18(25)23(19(16)26)13-5-3-2-4-6-13/h2-10,16,21H,11-12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccccc4 | |
| AKOS005250329 | 410.38 | C20 H18 N4 O6 | NKNCLFHSFWPBCN-UHFFFAOYSA-N | InChI=1S/C20H18N4O6/c1-29-17-9-7-15(8-10-17)23-18(20(26)30-21-23)12-22(14-5-6-14)19(25)13-3-2-4-16(11-13)24(27)28/h2-4,7-11,14H,5-6,12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4cccc(c4)[N+](=O)[O-] | |
| AKOS005250336 | 410.38 | C20 H18 N4 O6 | XJUOETXLCXLHJT-UHFFFAOYSA-N | InChI=1S/C20H18N4O6/c1-29-17-10-8-15(9-11-17)23-18(20(26)30-21-23)12-22(14-6-7-14)19(25)13-2-4-16(5-3-13)24(27)28/h2-5,8-11,14H,6-7,12H2,1H3/q-2 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4ccc(cc4)[N-](=O)[O-] | |
| AKOS005252688 | 422.46 | C20 H18 N6 O3 S | WEBNNWYHHIQOCA-UHFFFAOYSA-N | InChI=1S/C20H18N6O3S/c1-24(2)25-12-18(29-23-25)22-17(27)13-30-20-21-16-11-7-6-10-15(16)19(28)26(20)14-8-4-3-5-9-14/h3-12H,13H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3c(=O)n2c4ccccc4 | |
| AKOS005252948 | 422.46 | C20 H18 N6 O3 S | IKPSJJLCHGDAKY-UHFFFAOYSA-N | InChI=1S/C20H18N6O3S/c21-12-16-6-7-17(15-4-2-1-3-5-15)22-20(16)30-14-18(27)23-19-13-26(24-29-19)25-8-10-28-11-9-25/h1-7,13H,8-11,14H2 | c1ccc(cc1)c2ccc(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)C#N | |
| AKOS005252703 | 454.525 | C20 H18 N6 O3 S2 | ZHVHRMIFFZLJJG-LFIBNONCSA-N | InChI=1S/C20H18N6O3S2/c1-24(2)25-12-18(29-23-25)22-17(27)13-31-20-21-16(11-15-9-6-10-30-15)19(28)26(20)14-7-4-3-5-8-14/h3-12H,13H2,1-2H3/b16-11+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccs3)/C(=O)N2c4ccccc4 | |
| AKOS005252696 | 438.46 | C20 H18 N6 O4 S | VONVSIHKRSFZHG-LFIBNONCSA-N | InChI=1S/C20H18N6O4S/c1-24(2)25-12-18(30-23-25)22-17(27)13-31-20-21-16(11-15-9-6-10-29-15)19(28)26(20)14-7-4-3-5-8-14/h3-12H,13H2,1-2H3/b16-11+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccco3)/C(=O)N2c4ccccc4 | |
| AKOS005252707 | 434.474 | C20 H18 N8 O2 S | XDNGIEOTGRGVCB-UHFFFAOYSA-N | InChI=1S/C20H18N8O2S/c1-12-4-6-13(7-5-12)18-14(8-21)19(23)25-20(15(18)9-22)31-11-16(29)24-17-10-28(26-30-17)27(2)3/h4-7,10H,11H2,1-3H3,(H2-,23,24,25,26,29) | Cc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N(C)C)N)C#N | |
| AKOS005253071 | 466.539 | C20 H18 N8 O2 S2 | VKBPYEGFPCFTPI-UHFFFAOYSA-N | InChI=1S/C20H18N8O2S2/c21-9-13-18(15-5-4-8-31-15)14(10-22)20(25-19(13)23)32-12-16(29)24-17-11-28(26-30-17)27-6-2-1-3-7-27/h4-5,8,11H,1-3,6-7,12H2,(H2-,23,24,25,26,29) | c1cc(sc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)N)C#N | |
| AKOS005253077 | 450.474 | C20 H18 N8 O3 S | FLAZDRIQHQFFNS-UHFFFAOYSA-N | InChI=1S/C20H18N8O3S/c21-9-13-18(15-5-4-8-30-15)14(10-22)20(25-19(13)23)32-12-16(29)24-17-11-28(26-31-17)27-6-2-1-3-7-27/h4-5,8,11H,1-3,6-7,12H2,(H2-,23,24,25,26,29) | c1cc(oc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)N)C#N | |
| AKOS005250581 | 398.388 | C20 H19 F N4 O4 | ZWAMPBDAXHSOTJ-UHFFFAOYSA-N | InChI=1S/C20H19FN4O4/c1-28-15-8-6-14(7-9-15)25-18(20(27)29-22-25)19(26)24-12-10-23(11-13-24)17-5-3-2-4-16(17)21/h2-9H,10-13H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)c4ccccc4F | |
| AKOS005250582 | 398.388 | C20 H19 F N4 O4 | SAQHKEMRQKKELC-UHFFFAOYSA-N | InChI=1S/C20H19FN4O4/c1-28-17-8-6-16(7-9-17)25-18(20(27)29-22-25)19(26)24-12-10-23(11-13-24)15-4-2-14(21)3-5-15/h2-9H,10-13H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)c4ccc(cc4)F | |
| AKOS005219492 | 349.383 | C20 H19 N3 O3 | POYAAXWWHMSOBO-UHFFFAOYSA-N | InChI=1S/C20H19N3O3/c24-19(13-15-7-3-1-4-8-15)22(16-11-12-16)14-18-20(25)26-21-23(18)17-9-5-2-6-10-17/h1-10,16H,11-14H2 | c1ccc(cc1)CC(=O)N(Cc2c(on[n+]2c3ccccc3)[O-])C4CC4 | |
| AKOS005250285 | 349.383 | C20 H19 N3 O3 | OWFFWUQJPWUKGV-UHFFFAOYSA-N | InChI=1S/C20H19N3O3/c1-14-7-5-6-10-17(14)19(24)22(15-11-12-15)13-18-20(25)26-21-23(18)16-8-3-2-4-9-16/h2-10,15H,11-13H2,1H3 | Cc1ccccc1C(=O)N(Cc2c(on[n+]2c3ccccc3)[O-])C4CC4 | |
| AKOS005250316 | 349.383 | C20 H19 N3 O3 | VZDHIGVMHYFPLW-UHFFFAOYSA-N | InChI=1S/C20H19N3O3/c1-14-6-5-7-15(12-14)19(24)22(16-10-11-16)13-18-20(25)26-21-23(18)17-8-3-2-4-9-17/h2-9,12,16H,10-11,13H2,1H3 | Cc1cccc(c1)C(=O)N(Cc2c(on[n+]2c3ccccc3)[O-])C4CC4 | |
| AKOS005250317 | 349.383 | C20 H19 N3 O3 | WZYOOHXTKUGHSF-UHFFFAOYSA-N | InChI=1S/C20H19N3O3/c1-14-7-9-15(10-8-14)19(24)22(16-11-12-16)13-18-20(25)26-21-23(18)17-5-3-2-4-6-17/h2-10,16H,11-13H2,1H3 | Cc1ccc(cc1)C(=O)N(Cc2c(on[n+]2c3ccccc3)[O-])C4CC4 | |
| AKOS005250268 | 365.383 | C20 H19 N3 O4 | UNDCMNFOCUXNME-MDWZMJQESA-N | InChI=1S/C20H19N3O4/c1-22(19(24)13-8-15-6-4-3-5-7-15)14-18-20(25)27-21-23(18)16-9-11-17(26-2)12-10-16/h3-13H,14H2,1-2H3/b13-8+ | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)/C=C/c3ccccc3 | |
| AKOS005250347 | 365.383 | C20 H19 N3 O4 | QBPBVRSZORYSQA-UHFFFAOYSA-N | InChI=1S/C20H19N3O4/c1-26-17-9-5-6-14(12-17)19(24)22(15-10-11-15)13-18-20(25)27-21-23(18)16-7-3-2-4-8-16/h2-9,12,15H,10-11,13H2,1H3 | COc1cccc(c1)C(=O)N(Cc2c(on[n+]2c3ccccc3)[O-])C4CC4 | |
| AKOS005250348 | 365.383 | C20 H19 N3 O4 | GGTDPJLASGYYLD-UHFFFAOYSA-N | InChI=1S/C20H19N3O4/c1-26-17-11-7-14(8-12-17)19(24)22(15-9-10-15)13-18-20(25)27-21-23(18)16-5-3-2-4-6-16/h2-8,11-12,15H,9-10,13H2,1H3 | COc1ccc(cc1)C(=O)N(Cc2c(on[n+]2c3ccccc3)[O-])C4CC4 | |
| AKOS005250349 | 365.383 | C20 H19 N3 O4 | DPVHTSIDYZXPIJ-UHFFFAOYSA-N | InChI=1S/C20H19N3O4/c24-19(14-26-17-9-5-2-6-10-17)22(15-11-12-15)13-18-20(25)27-21-23(18)16-7-3-1-4-8-16/h1-10,15H,11-14H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)COc4ccccc4 | |
| AKOS005252075 | 397.448 | C20 H19 N3 O4 S | COAIWECYIWGBCB-UHFFFAOYSA-N | InChI=1S/C20H19N3O4S/c1-3-17(18(25)21-15-11-9-14(10-12-15)13(2)24)28-19-20(26)27-22-23(19)16-7-5-4-6-8-16/h4-12,17H,3H2,1-2H3,(H-,21,22,24,25,26) | CCC(C(=O)Nc1ccc(cc1)C(=O)C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250560 | 413.447 | C20 H19 N3 O5 S | MAIMZWCINZMFET-UHFFFAOYSA-N | InChI=1S/C20H19N3O5S/c1-23-16(20(26)28-22-23)17(24)21-18-15(19(25)27-2)13-9-8-12(10-14(13)29-18)11-6-4-3-5-7-11/h3-7,12H,8-10H2,1-2H3,(H-,21,22,24,25,26) | C[n+]1c(c(on1)[O-])C(=O)Nc2c(c3c(s2)CC(CC3)c4ccccc4)C(=O)OC | |
| AKOS005251491 | 413.447 | C20 H19 N3 O5 S | AFCSUYGYIZPLGM-UHFFFAOYSA-N | InChI=1S/C20H19N3O5S/c1-3-27-19(25)14-9-11-15(12-10-14)21-17(24)13(2)29-18-20(26)28-22-23(18)16-7-5-4-6-8-16/h4-13H,3H2,1-2H3,(H-,21,22,24,25,26) | CCOC(=O)c1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251796 | 413.447 | C20 H19 N3 O5 S | TUTQMDSRCBNGHE-UHFFFAOYSA-N | InChI=1S/C20H19N3O5S/c1-12(24)14-4-6-15(7-5-14)21-18(25)13(2)29-19-20(26)28-22-23(19)16-8-10-17(27-3)11-9-16/h4-11,13H,1-3H3,(H-,21,22,24,25,26) | CC(C(=O)Nc1ccc(cc1)C(=O)C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251906 | 413.447 | C20 H19 N3 O5 S | ZEYMKKWEAKIRBC-UHFFFAOYSA-N | InChI=1S/C20H19N3O5S/c1-3-16(17(24)21-15-11-13(19(25)26)10-9-12(15)2)29-18-20(27)28-22-23(18)14-7-5-4-6-8-14/h4-11,16H,3H2,1-2H3,(H2-,21,22,24,25,26,27) | CCC(C(=O)Nc1cc(ccc1C)C(=O)O)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251926 | 413.447 | C20 H19 N3 O5 S | APCRPZQHCNIPRU-UHFFFAOYSA-N | InChI=1S/C20H19N3O5S/c1-2-17(18(24)21-13-8-9-15-16(12-13)27-11-10-26-15)29-19-20(25)28-22-23(19)14-6-4-3-5-7-14/h3-9,12,17H,2,10-11H2,1H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc2c(c1)OCCO2)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252112 | 413.447 | C20 H19 N3 O5 S | RKCOOQGIMZNNEI-UHFFFAOYSA-N | InChI=1S/C20H19N3O5S/c1-3-16(17(24)21-15-12-8-7-11-14(15)19(25)27-2)29-18-20(26)28-22-23(18)13-9-5-4-6-10-13/h4-12,16H,3H2,1-2H3,(H-,21,22,24,25,26) | CCC(C(=O)Nc1ccccc1C(=O)OC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252233 | 413.447 | C20 H19 N3 O5 S | HSBROMDETOEIQM-UHFFFAOYSA-N | InChI=1S/C20H19N3O5S/c1-13(24)14-3-5-15(6-4-14)21-18(25)11-12-29-19-20(26)28-22-23(19)16-7-9-17(27-2)10-8-16/h3-10H,11-12H2,1-2H3,(H-,21,22,24,25,26) | CC(=O)c1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252253 | 413.447 | C20 H19 N3 O5 S | NTACOZAOXJZWRP-UHFFFAOYSA-N | InChI=1S/C20H19N3O5S/c1-2-27-19(25)14-8-10-15(11-9-14)21-17(24)12-13-29-18-20(26)28-22-23(18)16-6-4-3-5-7-16/h3-11H,2,12-13H2,1H3,(H-,21,22,24,25,26) | CCOC(=O)c1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251565 | 445.512 | C20 H19 N3 O5 S2 | SHXWTQLRBTWKFH-UHFFFAOYSA-N | InChI=1S/C20H19N3O5S2/c1-27-19(25)16-13-9-5-6-10-14(13)30-17(16)21-15(24)11-29-18-20(26)28-22-23(18)12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-11H2,1H3,(H-,21,22,24,25,26) | COC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])CCCC2 | |
| AKOS005250172 | 429.446 | C20 H19 N3 O6 S | QMMZFEMKHKKYHS-UHFFFAOYSA-N | InChI=1S/C20H19N3O6S/c1-27-12-9-7-11(8-10-12)23-16(20(26)29-22-23)17(24)21-18-15(19(25)28-2)13-5-3-4-6-14(13)30-18/h7-10H,3-6H2,1-2H3,(H-,21,22,24,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3c(c4c(s3)CCCC4)C(=O)OC | |
| AKOS005251532 | 429.446 | C20 H19 N3 O6 S | NFUCBFJOAXYHLX-UHFFFAOYSA-N | InChI=1S/C20H19N3O6S/c1-3-28-19(25)13-4-6-14(7-5-13)21-17(24)12-30-18-20(26)29-22-23(18)15-8-10-16(27-2)11-9-15/h4-11H,3,12H2,1-2H3,(H-,21,22,24,25,26) | CCOC(=O)c1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251816 | 429.446 | C20 H19 N3 O6 S | SXXVGFWQLYCWJN-UHFFFAOYSA-N | InChI=1S/C20H19N3O6S/c1-12(18(24)21-13-3-8-16-17(11-13)28-10-9-27-16)30-19-20(25)29-22-23(19)14-4-6-15(26-2)7-5-14/h3-8,11-12H,9-10H2,1-2H3,(H-,21,22,24,25) | CC(C(=O)Nc1ccc2c(c1)OCCO2)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005251853 | 429.446 | C20 H19 N3 O6 S | GPRSGBQYVMKSIX-UHFFFAOYSA-N | InChI=1S/C20H19N3O6S/c1-12(17(24)21-16-7-5-4-6-15(16)19(25)28-3)30-18-20(26)29-22-23(18)13-8-10-14(27-2)11-9-13/h4-12H,1-3H3,(H-,21,22,24,25,26) | CC(C(=O)Nc1ccccc1C(=O)OC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251862 | 429.446 | C20 H19 N3 O6 S | UQDXFBLERLEOOZ-UHFFFAOYSA-N | InChI=1S/C20H19N3O6S/c1-11-4-5-13(19(25)26)10-16(11)21-17(24)12(2)30-18-20(27)29-22-23(18)14-6-8-15(28-3)9-7-14/h4-10,12H,1-3H3,(H2-,21,22,24,25,26,27) | Cc1ccc(cc1NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-])C(=O)O | |
| AKOS005251893 | 429.446 | C20 H19 N3 O6 S | XPKROOQZQBVNQA-UHFFFAOYSA-N | InChI=1S/C20H19N3O6S/c1-3-16(17(24)21-13-6-4-12(5-7-13)19(25)26)30-18-20(27)29-22-23(18)14-8-10-15(28-2)11-9-14/h4-11,16H,3H2,1-2H3,(H2-,21,22,24,25,26,27) | CCC(C(=O)Nc1ccc(cc1)C(=O)O)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251929 | 429.446 | C20 H19 N3 O6 S | IZYGMCYNCXNXNP-UHFFFAOYSA-N | InChI=1S/C20H19N3O6S/c1-3-16(17(24)21-14-10-9-12(19(25)26)11-15(14)28-2)30-18-20(27)29-22-23(18)13-7-5-4-6-8-13/h4-11,16H,3H2,1-2H3,(H2-,21,22,24,25,26,27) | CCC(C(=O)Nc1ccc(cc1OC)C(=O)O)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251942 | 429.446 | C20 H19 N3 O6 S | OTOGWLLBDLFTIY-UHFFFAOYSA-N | InChI=1S/C20H19N3O6S/c1-3-17(18(24)21-12-4-9-15-16(10-12)28-11-27-15)30-19-20(25)29-22-23(19)13-5-7-14(26-2)8-6-13/h4-10,17H,3,11H2,1-2H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc2c(c1)OCO2)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252001 | 429.446 | C20 H19 N3 O6 S | BKDRESKEAQLGJY-UHFFFAOYSA-N | InChI=1S/C20H19N3O6S/c1-3-16(17(24)21-13-6-4-5-12(11-13)19(25)26)30-18-20(27)29-22-23(18)14-7-9-15(28-2)10-8-14/h4-11,16H,3H2,1-2H3,(H2-,21,22,24,25,26,27) | CCC(C(=O)Nc1cccc(c1)C(=O)O)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252212 | 429.446 | C20 H19 N3 O6 S | AEULWIDKMRNVHN-UHFFFAOYSA-N | InChI=1S/C20H19N3O6S/c1-27-14-9-7-13(8-10-14)23-18(20(26)29-22-23)30-12-11-17(24)21-16-6-4-3-5-15(16)19(25)28-2/h3-10H,11-12H2,1-2H3,(H-,21,22,24,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccccc3C(=O)OC | |
| AKOS005252221 | 429.446 | C20 H19 N3 O6 S | WGGSZDIYPCKCBH-UHFFFAOYSA-N | InChI=1S/C20H19N3O6S/c1-26-15-5-3-14(4-6-15)23-19(20(25)29-22-23)30-11-8-18(24)21-13-2-7-16-17(12-13)28-10-9-27-16/h2-7,12H,8-11H2,1H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc4c(c3)OCCO4 | |
| AKOS005252229 | 429.446 | C20 H19 N3 O6 S | VGHYSBRFDFJNAZ-UHFFFAOYSA-N | InChI=1S/C20H19N3O6S/c1-12-3-4-13(19(25)26)11-16(12)21-17(24)9-10-30-18-20(27)29-22-23(18)14-5-7-15(28-2)8-6-14/h3-8,11H,9-10H2,1-2H3,(H2-,21,22,24,25,26,27) | Cc1ccc(cc1NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-])C(=O)O | |
| AKOS005251801 | 445.446 | C20 H19 N3 O7 S | GAIDHPCSKCHNOK-UHFFFAOYSA-N | InChI=1S/C20H19N3O7S/c1-11(17(24)21-15-9-4-12(19(25)26)10-16(15)29-3)31-18-20(27)30-22-23(18)13-5-7-14(28-2)8-6-13/h4-11H,1-3H3,(H2-,21,22,24,25,26,27) | CC(C(=O)Nc1ccc(cc1OC)C(=O)O)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251910 | 445.446 | C20 H19 N3 O7 S | RDKFHLBVBLYPJI-UHFFFAOYSA-N | InChI=1S/C20H19N3O7S/c1-3-16(17(25)21-11-4-9-15(24)14(10-11)19(26)27)31-18-20(28)30-22-23(18)12-5-7-13(29-2)8-6-12/h4-10,16,22H,3H2,1-2H3,(H2,26,27,28) | CCC(C(=O)Nc1ccc(c(c1)C(=O)O)O)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252650 | 445.446 | C20 H19 N3 O7 S | LORCHALKFGHVKM-UHFFFAOYSA-N | InChI=1S/C20H19N3O7S/c1-28-14-6-4-13(5-7-14)23-18(20(27)30-22-23)31-10-9-17(24)21-15-8-3-12(19(25)26)11-16(15)29-2/h3-8,11H,9-10H2,1-2H3,(H2-,21,22,24,25,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3OC)C(=O)O | |
| AKOS005252863 | 393.462 | C20 H19 N5 O2 S | PAWACUBZDAZRQD-UHFFFAOYSA-N | InChI=1S/C20H19N5O2S/c1-13(2)25-11-19(27-24-25)23-18(26)12-28-20-16(10-21)8-9-17(22-20)15-6-4-14(3)5-7-15/h4-9,11,13H,12H2,1-3H3 | Cc1ccc(cc1)c2ccc(c(n2)SCC(=O)[N-]c3c[n+](no3)C(C)C)C#N | |
| AKOS005252862 | 409.462 | C20 H19 N5 O3 S | XFOZLDHRNYXVCO-UHFFFAOYSA-N | InChI=1S/C20H19N5O3S/c1-13(2)25-11-19(28-24-25)23-18(26)12-29-20-15(10-21)6-9-17(22-20)14-4-7-16(27-3)8-5-14/h4-9,11,13H,12H2,1-3H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)c3ccc(cc3)OC)C#N | |
| AKOS005253311 | 409.462 | C20 H19 N5 O3 S | MHFRPWMCVLQAGH-UHFFFAOYSA-N | InChI=1S/C20H19N5O3S/c1-14-3-5-15(6-4-14)17-8-7-16(11-21)20(22-17)29-13-18(26)23-19-12-25(24-28-19)9-10-27-2/h3-8,12H,9-10,13H2,1-2H3 | Cc1ccc(cc1)c2ccc(c(n2)SCC(=O)[N-]c3c[n+](no3)CCOC)C#N | |
| AKOS005251569 | 441.527 | C20 H19 N5 O3 S2 | IOOYSLLQFKMSMA-UHFFFAOYSA-N | InChI=1S/C20H19N5O3S2/c1-24-19(20(27)28-23-24)29-12-17(26)22-18-15(9-21)14-7-8-25(11-16(14)30-18)10-13-5-3-2-4-6-13/h2-6H,7-8,10-12H2,1H3,(H-,22,23,26,27) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2c(c3c(s2)CN(CC3)Cc4ccccc4)C#N | |
| AKOS005253310 | 425.461 | C20 H19 N5 O4 S | ANPNKWGPXMIIEE-UHFFFAOYSA-N | InChI=1S/C20H19N5O4S/c1-27-10-9-25-12-19(29-24-25)23-18(26)13-30-20-15(11-21)5-8-17(22-20)14-3-6-16(28-2)7-4-14/h3-8,12H,9-10,13H2,1-2H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(ccc(n2)c3ccc(cc3)OC)C#N | |
| AKOS005251968 | 457.526 | C20 H19 N5 O4 S2 | CKBWZEPWQBHABS-UHFFFAOYSA-N | InChI=1S/C20H19N5O4S2/c1-4-14(30-19-20(28)29-24-25(19)3)16(26)23-18-13(10-21)11(2)15(31-18)17(27)22-12-8-6-5-7-9-12/h5-9,14H,4H2,1-3H3,(H2-,22,23,24,26,27,28) | CCC(C(=O)Nc1c(c(c(s1)C(=O)Nc2ccccc2)C)C#N)Sc3c(on[n+]3C)[O-] | |
| AKOS005250625 | 425.395 | C20 H19 N5 O6 | VCGIRURRWCSANG-UHFFFAOYSA-N | InChI=1S/C20H19N5O6/c1-30-17-8-6-15(7-9-17)24-18(20(27)31-21-24)19(26)23-12-10-22(11-13-23)14-2-4-16(5-3-14)25(28)29/h2-9H,10-13H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)c4ccc(cc4)[N+](=O)[O-] | |
| AKOS005253184 | 473.459 | C20 H19 N5 O7 S | BNGASKFSWFVLEK-UHFFFAOYSA-N | InChI=1S/C20H19N5O7S/c1-31-14-6-2-13(3-7-14)25-17(20(28)32-23-25)11-22-16-10-18(26)24(19(16)27)12-4-8-15(9-5-12)33(21,29)30/h2-9,16,22H,10-11H2,1H3,(H2-,21,23,28,29,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)S(=O)(=O)N | |
| AKOS005251726 | 433.908 | C20 H20 Cl N3 O4 S | PUSIVNOJSQIZNW-UHFFFAOYSA-N | InChI=1S/C20H20ClN3O4S/c1-4-17(18(25)22-16-7-5-6-15(21)12(16)2)29-19-20(26)28-23-24(19)13-8-10-14(27-3)11-9-13/h5-11,17H,4H2,1-3H3,(H-,22,23,25,26) | CCC(C(=O)Nc1cccc(c1C)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252040 | 433.908 | C20 H20 Cl N3 O4 S | XUJCTXRPFLZXSM-UHFFFAOYSA-N | InChI=1S/C20H20ClN3O4S/c1-4-17(18(25)22-15-10-12(2)14(21)11-16(15)27-3)29-19-20(26)28-23-24(19)13-8-6-5-7-9-13/h5-11,17H,4H2,1-3H3,(H-,22,23,25,26) | CCC(C(=O)Nc1cc(c(cc1OC)Cl)C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252115 | 433.908 | C20 H20 Cl N3 O4 S | PRFZZZVEXMZTJK-UHFFFAOYSA-N | InChI=1S/C20H20ClN3O4S/c1-4-17(18(25)22-13-6-5-12(2)16(21)11-13)29-19-20(26)28-23-24(19)14-7-9-15(27-3)10-8-14/h5-11,17H,4H2,1-3H3,(H-,22,23,25,26) | CCC(C(=O)Nc1ccc(c(c1)Cl)C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252124 | 433.908 | C20 H20 Cl N3 O4 S | FXYKQJUTDKHNJN-UHFFFAOYSA-N | InChI=1S/C20H20ClN3O4S/c1-4-17(18(25)22-16-11-13(21)6-5-12(16)2)29-19-20(26)28-23-24(19)14-7-9-15(27-3)10-8-14/h5-11,17H,4H2,1-3H3,(H-,22,23,25,26) | CCC(C(=O)Nc1cc(ccc1C)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251851 | 449.908 | C20 H20 Cl N3 O5 S | HCURIGMFFGALRE-UHFFFAOYSA-N | InChI=1S/C20H20ClN3O5S/c1-11-9-16(17(28-4)10-15(11)21)22-18(25)12(2)30-19-20(26)29-23-24(19)13-5-7-14(27-3)8-6-13/h5-10,12H,1-4H3,(H-,22,23,25,26) | Cc1cc(c(cc1Cl)OC)NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251995 | 449.908 | C20 H20 Cl N3 O5 S | LYBHINGTUOGPIR-UHFFFAOYSA-N | InChI=1S/C20H20ClN3O5S/c1-4-17(18(25)22-15-11-12(21)5-10-16(15)28-3)30-19-20(26)29-23-24(19)13-6-8-14(27-2)9-7-13/h5-11,17H,4H2,1-3H3,(H-,22,23,25,26) | CCC(C(=O)Nc1cc(ccc1OC)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252010 | 449.908 | C20 H20 Cl N3 O5 S | CNOFGMCIGBJANP-UHFFFAOYSA-N | InChI=1S/C20H20ClN3O5S/c1-4-17(18(25)22-12-5-10-16(28-3)15(21)11-12)30-19-20(26)29-23-24(19)13-6-8-14(27-2)9-7-13/h5-11,17H,4H2,1-3H3,(H-,22,23,25,26) | CCC(C(=O)Nc1ccc(c(c1)Cl)OC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252084 | 449.908 | C20 H20 Cl N3 O5 S | OWRNDGUFCPHBSD-UHFFFAOYSA-N | InChI=1S/C20H20ClN3O5S/c1-4-17(18(25)22-14-10-13(21)15(27-2)11-16(14)28-3)30-19-20(26)29-23-24(19)12-8-6-5-7-9-12/h5-11,17H,4H2,1-3H3,(H-,22,23,25,26) | CCC(C(=O)Nc1cc(c(cc1OC)OC)Cl)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252218 | 449.908 | C20 H20 Cl N3 O5 S | CQTAWIAUIGTHQV-UHFFFAOYSA-N | InChI=1S/C20H20ClN3O5S/c1-12-10-16(17(28-3)11-15(12)21)22-18(25)8-9-30-19-20(26)29-23-24(19)13-4-6-14(27-2)7-5-13/h4-7,10-11H,8-9H2,1-3H3,(H-,22,23,25,26) | Cc1cc(c(cc1Cl)OC)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251797 | 465.907 | C20 H20 Cl N3 O6 S | TYOPWRJKYJVJIF-UHFFFAOYSA-N | InChI=1S/C20H20ClN3O6S/c1-11(18(25)22-15-9-14(21)16(28-3)10-17(15)29-4)31-19-20(26)30-23-24(19)12-5-7-13(27-2)8-6-12/h5-11H,1-4H3,(H-,22,23,25,26) | CC(C(=O)Nc1cc(c(cc1OC)OC)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252234 | 465.907 | C20 H20 Cl N3 O6 S | VJIAOGPCOLIRIU-UHFFFAOYSA-N | InChI=1S/C20H20ClN3O6S/c1-27-13-6-4-12(5-7-13)24-19(20(26)30-23-24)31-9-8-18(25)22-15-10-14(21)16(28-2)11-17(15)29-3/h4-7,10-11H,8-9H2,1-3H3,(H-,22,23,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cc(c(cc3OC)OC)Cl | |
| AKOS005215528 | 455.451 | C20 H20 F3 N3 O4 S | KNPILUSFCHXZNK-UHFFFAOYSA-N | InChI=1S/C20H20F3N3O4S/c1-12(2)26-17(18(27)14-6-8-15(9-7-14)20(21,22)23)19(30-25-26)24-31(28,29)16-10-4-13(3)5-11-16/h4-12,18,27H,1-3H3 | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)C(c3ccc(cc3)C(F)(F)F)O | |
| AKOS005214723 | 348.398 | C20 H20 N4 O2 | VYBSUWAVAYHGKD-UHFFFAOYSA-N | InChI=1S/C20H20N4O2/c1-14-6-8-16(9-7-14)24-19(20(25)26-23-24)13-21-11-10-15-12-22-18-5-3-2-4-17(15)18/h2-9,12,21-22H,10-11,13H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3c[nH]c4c3cccc4 | |
| AKOS005219822 | 380.463 | C20 H20 N4 O2 S | ZHQCERNFIOYWNY-UHFFFAOYSA-N | InChI=1S/C20H20N4O2S/c25-19-18(24(22-26-19)17-9-5-2-6-10-17)14-23(20(27)21-16-11-12-16)13-15-7-3-1-4-8-15/h1-10,16H,11-14H2,(H-,21,22,25,27) | c1ccc(cc1)CN(Cc2c(on[n+]2c3ccccc3)[O-])C(=S)NC4CC4 | |
| AKOS005214721 | 364.398 | C20 H20 N4 O3 | YOJKHNWNXFFYOZ-UHFFFAOYSA-N | InChI=1S/C20H20N4O3/c1-26-16-8-6-15(7-9-16)24-19(20(25)27-23-24)13-21-11-10-14-12-22-18-5-3-2-4-17(14)18/h2-9,12,21-22H,10-11,13H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3c[nH]c4c3cccc4 | |
| AKOS005250480 | 364.398 | C20 H20 N4 O3 | VMNBTCXEJAFGMW-UHFFFAOYSA-N | InChI=1S/C20H20N4O3/c1-15-7-9-16(10-8-15)22-11-13-23(14-12-22)19(25)18-20(26)27-21-24(18)17-5-3-2-4-6-17/h2-10H,11-14H2,1H3 | Cc1ccc(cc1)N2CCN(CC2)C(=O)c3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250497 | 364.398 | C20 H20 N4 O3 | WUAXNYFJOLSYFO-UHFFFAOYSA-N | InChI=1S/C20H20N4O3/c25-19(18-20(26)27-21-24(18)17-9-5-2-6-10-17)23-13-11-22(12-14-23)15-16-7-3-1-4-8-16/h1-10H,11-15H2 | c1ccc(cc1)CN2CCN(CC2)C(=O)c3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005219777 | 396.463 | C20 H20 N4 O3 S | JFBDUABCQPHFOI-UHFFFAOYSA-N | InChI=1S/C20H20N4O3S/c1-26-17-11-9-16(10-12-17)24-18(19(25)27-22-24)13-23(15-7-8-15)20(28)21-14-5-3-2-4-6-14/h2-6,9-12,15H,7-8,13H2,1H3,(H-,21,22,25,28) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=S)Nc4ccccc4 | |
| AKOS005250573 | 380.397 | C20 H20 N4 O4 | LWMXUGVHICJLKX-UHFFFAOYSA-N | InChI=1S/C20H20N4O4/c1-27-17-9-7-16(8-10-17)24-18(20(26)28-21-24)19(25)23-13-11-22(12-14-23)15-5-3-2-4-6-15/h2-10H,11-14H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)c4ccccc4 | |
| AKOS005252003 | 412.462 | C20 H20 N4 O4 S | KANJFLDWSBMOBY-UHFFFAOYSA-N | InChI=1S/C20H20N4O4S/c1-3-17(18(26)22-15-11-9-14(10-12-15)21-13(2)25)29-19-20(27)28-23-24(19)16-7-5-4-6-8-16/h4-12,17,23,27H,3H2,1-2H3 | CCC(C(=O)Nc1ccc(cc1)NC(=O)C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005250095 | 396.397 | C20 H20 N4 O5 | QVARAOCMKLFDHT-UHFFFAOYSA-N | InChI=1S/C20H20N4O5/c1-22(12-17-20(28)29-21-24(17)16-10-6-3-7-11-16)18(25)13-23(14-19(26)27)15-8-4-2-5-9-15/h2-11H,12-14H2,1H3,(H-,21,26,27,28) | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)CN(CC(=O)O)c3ccccc3 | |
| AKOS005250588 | 428.462 | C20 H20 N4 O5 S | VTQDYNNICGDUKB-UHFFFAOYSA-N | InChI=1S/C20H20N4O5S/c1-23-16(20(27)29-22-23)17(25)21-18-15(19(26)28-2)13-8-9-24(11-14(13)30-18)10-12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3,(H-,21,22,25,26,27) | C[n+]1c(c(on1)[O-])C(=O)Nc2c(c3c(s2)CN(CC3)Cc4ccccc4)C(=O)OC | |
| AKOS005251838 | 428.462 | C20 H20 N4 O5 S | REPUPWFARKFAHT-UHFFFAOYSA-N | InChI=1S/C20H20N4O5S/c1-12(18(26)22-15-6-4-14(5-7-15)21-13(2)25)30-19-20(27)29-23-24(19)16-8-10-17(28-3)11-9-16/h4-12,23,27H,1-3H3 | CC(C(=O)Nc1ccc(cc1)NC(=O)C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251901 | 428.462 | C20 H20 N4 O5 S | SNWPXGNKLLRTGL-UHFFFAOYSA-N | InChI=1S/C20H20N4O5S/c1-3-16(18(26)22-13-6-4-12(5-7-13)17(21)25)30-19-20(27)29-23-24(19)14-8-10-15(28-2)11-9-14/h4-11,16H,3H2,1-2H3,(H3-,21,22,23,25,26,27) | CCC(C(=O)Nc1ccc(cc1)C(=O)N)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251904 | 428.462 | C20 H20 N4 O5 S | ANVQYTKOULNPGJ-UHFFFAOYSA-N | InChI=1S/C20H20N4O5S/c1-3-16(18(26)22-15-7-5-4-6-14(15)17(21)25)30-19-20(27)29-23-24(19)12-8-10-13(28-2)11-9-12/h4-11,16H,3H2,1-2H3,(H3-,21,22,23,25,26,27) | CCC(C(=O)Nc1ccccc1C(=O)N)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252237 | 428.462 | C20 H20 N4 O5 S | QQWBDZURDSWYDT-UHFFFAOYSA-N | InChI=1S/C20H20N4O5S/c1-13(25)21-14-3-5-15(6-4-14)22-18(26)11-12-30-19-20(27)29-23-24(19)16-7-9-17(28-2)10-8-16/h3-10,23,27H,11-12H2,1-2H3 | CC(=O)Nc1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252066 | 444.461 | C20 H20 N4 O6 S | LQSGHIPZNSHMPA-UHFFFAOYSA-N | InChI=1S/C20H20N4O6S/c1-4-17(18(25)21-16-10-7-14(24(27)28)11-12(16)2)31-19-20(26)30-22-23(19)13-5-8-15(29-3)9-6-13/h5-11,17H,4H2,1-3H3,(H-,21,22,25,26) | CCC(C(=O)Nc1ccc(cc1C)[N+](=O)[O-])Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252113 | 444.461 | C20 H20 N4 O6 S | XRHAGSKKNJEIKL-UHFFFAOYSA-N | InChI=1S/C20H20N4O6S/c1-4-17(18(25)21-16-11-14(24(27)28)6-5-12(16)2)31-19-20(26)30-22-23(19)13-7-9-15(29-3)10-8-13/h5-11,17H,4H2,1-3H3,(H-,21,22,25,26) | CCC(C(=O)Nc1cc(ccc1C)[N+](=O)[O-])Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251587 | 476.526 | C20 H20 N4 O6 S2 | FZESCPVKAHJFRK-UHFFFAOYSA-N | InChI=1S/C20H20N4O6S2/c1-4-29-19(27)14-11(2)15(16(26)21-12-8-6-5-7-9-12)32-17(14)22-13(25)10-31-18-20(28)30-23-24(18)3/h5-9H,4,10H2,1-3H3,(H2-,21,22,23,25,26,27,28) | CCOC(=O)c1c(c(sc1NC(=O)CSc2c(on[n+]2C)[O-])C(=O)Nc3ccccc3)C | |
| AKOS005251658 | 476.526 | C20 H20 N4 O6 S2 | YJMRQXSVCGJNGG-UHFFFAOYSA-N | InChI=1S/C20H20N4O6S2/c1-10-13(19(27)29-4)17(32-14(10)16(26)21-12-8-6-5-7-9-12)22-15(25)11(2)31-18-20(28)30-23-24(18)3/h5-9,11H,1-4H3,(H2-,21,22,23,25,26,27,28) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)C(C)Sc3c(on[n+]3C)[O-])C(=O)OC | |
| AKOS005252656 | 476.526 | C20 H20 N4 O6 S2 | DVVWLSXMEUFUSV-UHFFFAOYSA-N | InChI=1S/C20H20N4O6S2/c1-11-14(19(27)29-3)17(32-15(11)16(26)21-12-7-5-4-6-8-12)22-13(25)9-10-31-18-20(28)30-23-24(18)2/h4-8H,9-10H2,1-3H3,(H2-,21,22,23,25,26,27,28) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)CCSc3c(on[n+]3C)[O-])C(=O)OC | |
| AKOS005215411 | 446.277 | C20 H21 Br N3 O2 P | CQRZZUIITSPZFA-UHFFFAOYSA-N | InChI=1S/C20H21BrN3O2P/c1-14(2)24-20(19(26-23-24)22-18(25)15(3)21)27(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-15H,1-3H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)C(C)Br)P(c2ccccc2)c3ccccc3 | |
| AKOS005251490 | 383.464 | C20 H21 N3 O3 S | WEVKNCISBNPXJM-UHFFFAOYSA-N | InChI=1S/C20H21N3O3S/c1-13(2)15-9-11-16(12-10-15)21-18(24)14(3)27-19-20(25)26-22-23(19)17-7-5-4-6-8-17/h4-14H,1-3H3,(H-,21,22,24,25) | CC(C)c1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251883 | 383.464 | C20 H21 N3 O3 S | OKUFWZRIFJAMSS-UHFFFAOYSA-N | InChI=1S/C20H21N3O3S/c1-4-15-10-8-9-13(2)17(15)21-18(24)14(3)27-19-20(25)26-22-23(19)16-11-6-5-7-12-16/h5-12,14H,4H2,1-3H3,(H-,21,22,24,25) | CCc1cccc(c1NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-])C | |
| AKOS005252019 | 383.464 | C20 H21 N3 O3 S | LXEGNMSKSKRRTH-UHFFFAOYSA-N | InChI=1S/C20H21N3O3S/c1-4-17(18(24)21-15-11-13(2)10-14(3)12-15)27-19-20(25)26-22-23(19)16-8-6-5-7-9-16/h5-12,17H,4H2,1-3H3,(H-,21,22,24,25) | CCC(C(=O)Nc1cc(cc(c1)C)C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252086 | 383.464 | C20 H21 N3 O3 S | LKRCYLYTBFVSOE-UHFFFAOYSA-N | InChI=1S/C20H21N3O3S/c1-4-16(18(24)21-17-13(2)9-8-10-14(17)3)27-19-20(25)26-22-23(19)15-11-6-5-7-12-15/h5-12,16H,4H2,1-3H3,(H-,21,22,24,25) | CCC(C(=O)Nc1c(cccc1C)C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252121 | 383.464 | C20 H21 N3 O3 S | FERGMVWKUGKFRS-UHFFFAOYSA-N | InChI=1S/C20H21N3O3S/c1-4-17(18(24)21-16-12-13(2)10-11-14(16)3)27-19-20(25)26-22-23(19)15-8-6-5-7-9-15/h5-12,17H,4H2,1-3H3,(H-,21,22,24,25) | CCC(C(=O)Nc1cc(ccc1C)C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252127 | 383.464 | C20 H21 N3 O3 S | ASVYLWUQOVQTJS-UHFFFAOYSA-N | InChI=1S/C20H21N3O3S/c1-4-17(18(24)21-16-12-8-9-13(2)14(16)3)27-19-20(25)26-22-23(19)15-10-6-5-7-11-15/h5-12,17H,4H2,1-3H3,(H-,21,22,24,25) | CCC(C(=O)Nc1cccc(c1C)C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252130 | 383.464 | C20 H21 N3 O3 S | ZWFXZJKPWHTDPQ-UHFFFAOYSA-N | InChI=1S/C20H21N3O3S/c1-4-17(18(24)21-15-11-10-13(2)14(3)12-15)27-19-20(25)26-22-23(19)16-8-6-5-7-9-16/h5-12,17H,4H2,1-3H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc(c(c1)C)C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252136 | 383.464 | C20 H21 N3 O3 S | PCTLXYMLVUOQKV-UHFFFAOYSA-N | InChI=1S/C20H21N3O3S/c1-4-17(18(24)21-16-11-10-13(2)12-14(16)3)27-19-20(25)26-22-23(19)15-8-6-5-7-9-15/h5-12,17H,4H2,1-3H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc(cc1C)C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252144 | 383.464 | C20 H21 N3 O3 S | GHHYMBVVONHXAG-UHFFFAOYSA-N | InChI=1S/C20H21N3O3S/c1-3-15-9-7-8-14(2)18(15)21-17(24)12-13-27-19-20(25)26-22-23(19)16-10-5-4-6-11-16/h4-11H,3,12-13H2,1-2H3,(H-,21,22,24,25) | CCc1cccc(c1NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-])C | |
| AKOS005252252 | 383.464 | C20 H21 N3 O3 S | INPHYJHTKDWIJH-UHFFFAOYSA-N | InChI=1S/C20H21N3O3S/c1-14(2)15-8-10-16(11-9-15)21-18(24)12-13-27-19-20(25)26-22-23(19)17-6-4-3-5-7-17/h3-11,14H,12-13H2,1-2H3,(H-,21,22,24,25) | CC(C)c1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251169 | 399.463 | C20 H21 N3 O4 S | XOSBNTIZPBTGPQ-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-2-3-13-26-17-11-9-15(10-12-17)21-18(24)14-28-19-20(25)27-22-23(19)16-7-5-4-6-8-16/h4-12H,2-3,13-14H2,1H3,(H-,21,22,24,25) | CCCCOc1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251538 | 399.463 | C20 H21 N3 O4 S | MCFYCJFHMYDQIL-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-4-14-7-5-6-13(2)18(14)21-17(24)12-28-19-20(25)27-22-23(19)15-8-10-16(26-3)11-9-15/h5-11H,4,12H2,1-3H3,(H-,21,22,24,25) | CCc1cccc(c1NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005251650 | 399.463 | C20 H21 N3 O4 S | SHCHESMJDDOANI-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-13(2)14-4-6-15(7-5-14)21-18(24)12-28-19-20(25)27-22-23(19)16-8-10-17(26-3)11-9-16/h4-11,13H,12H2,1-3H3,(H-,21,22,24,25) | CC(C)c1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251810 | 399.463 | C20 H21 N3 O4 S | UYLAPLOSMCYYSV-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-12-6-5-7-17(13(12)2)21-18(24)14(3)28-19-20(25)27-22-23(19)15-8-10-16(26-4)11-9-15/h5-11,14H,1-4H3,(H-,21,22,24,25) | Cc1cccc(c1C)NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251811 | 399.463 | C20 H21 N3 O4 S | QPFMREGQGVGFHK-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-12-5-10-17(13(2)11-12)21-18(24)14(3)28-19-20(25)27-22-23(19)15-6-8-16(26-4)9-7-15/h5-11,14H,1-4H3,(H-,21,22,24,25) | Cc1ccc(c(c1)C)NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251818 | 399.463 | C20 H21 N3 O4 S | OFRBPECBHKRHCF-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-12-5-6-13(2)17(11-12)21-18(24)14(3)28-19-20(25)27-22-23(19)15-7-9-16(26-4)10-8-15/h5-11,14H,1-4H3,(H-,21,22,24,25) | Cc1ccc(c(c1)NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005251819 | 399.463 | C20 H21 N3 O4 S | RLENICGMVMIMPJ-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-12-5-6-15(11-13(12)2)21-18(24)14(3)28-19-20(25)27-22-23(19)16-7-9-17(26-4)10-8-16/h5-11,14H,1-4H3,(H-,21,22,24,25) | Cc1ccc(cc1C)NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251821 | 399.463 | C20 H21 N3 O4 S | UUMPHOILDHUPOV-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-12-6-5-7-13(2)17(12)21-18(24)14(3)28-19-20(25)27-22-23(19)15-8-10-16(26-4)11-9-15/h5-11,14H,1-4H3,(H-,21,22,24,25) | Cc1cccc(c1NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005251826 | 399.463 | C20 H21 N3 O4 S | GVURRTMGNXDOGN-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-12-9-13(2)11-15(10-12)21-18(24)14(3)28-19-20(25)27-22-23(19)16-5-7-17(26-4)8-6-16/h5-11,14H,1-4H3,(H-,21,22,24,25) | Cc1cc(cc(c1)NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005252026 | 399.463 | C20 H21 N3 O4 S | LBWNYEUGLWSILN-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-4-17(18(24)21-16-8-6-5-7-13(16)2)28-19-20(25)27-22-23(19)14-9-11-15(26-3)12-10-14/h5-12,17H,4H2,1-3H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccccc1C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252029 | 399.463 | C20 H21 N3 O4 S | XPMBDAACMDCCGV-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-4-17(18(24)21-14-7-5-6-13(2)12-14)28-19-20(25)27-22-23(19)15-8-10-16(26-3)11-9-15/h5-12,17H,4H2,1-3H3,(H-,21,22,24,25) | CCC(C(=O)Nc1cccc(c1)C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252032 | 399.463 | C20 H21 N3 O4 S | RZCMOYFBUYAQDY-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-4-17(18(24)21-14-7-5-13(2)6-8-14)28-19-20(25)27-22-23(19)15-9-11-16(26-3)12-10-15/h5-12,17H,4H2,1-3H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc(cc1)C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252049 | 399.463 | C20 H21 N3 O4 S | UEBOZNNFCOSHHY-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-3-17(18(24)21-15-12-8-9-13-16(15)26-4-2)28-19-20(25)27-22-23(19)14-10-6-5-7-11-14/h5-13,17H,3-4H2,1-2H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccccc1OCC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252082 | 399.463 | C20 H21 N3 O4 S | LRIQVVRAIYPZPH-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-3-17(18(24)21-14-10-12-16(13-11-14)26-4-2)28-19-20(25)27-22-23(19)15-8-6-5-7-9-15/h5-13,17H,3-4H2,1-2H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc(cc1)OCC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252177 | 399.463 | C20 H21 N3 O4 S | ZRCZDYDPEAHSAB-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-13-5-4-6-17(14(13)2)21-18(24)11-12-28-19-20(25)27-22-23(19)15-7-9-16(26-3)10-8-15/h4-10H,11-12H2,1-3H3,(H-,21,22,24,25) | Cc1cccc(c1C)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252178 | 399.463 | C20 H21 N3 O4 S | VKDDWNNZAUFLSS-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-13-4-9-17(14(2)12-13)21-18(24)10-11-28-19-20(25)27-22-23(19)15-5-7-16(26-3)8-6-15/h4-9,12H,10-11H2,1-3H3,(H-,21,22,24,25) | Cc1ccc(c(c1)C)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252180 | 399.463 | C20 H21 N3 O4 S | JZYUJMLKPOVAIF-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-13-5-4-6-14(2)18(13)21-17(24)11-12-28-19-20(25)27-22-23(19)15-7-9-16(26-3)10-8-15/h4-10H,11-12H2,1-3H3,(H-,21,22,24,25) | Cc1cccc(c1NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005252185 | 399.463 | C20 H21 N3 O4 S | MLZUWHSZZSWDAF-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-13-4-5-14(2)17(12-13)21-18(24)10-11-28-19-20(25)27-22-23(19)15-6-8-16(26-3)9-7-15/h4-9,12H,10-11H2,1-3H3,(H-,21,22,24,25) | Cc1ccc(c(c1)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005252186 | 399.463 | C20 H21 N3 O4 S | PDCZHBCOQIVTJS-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-13-4-5-15(12-14(13)2)21-18(24)10-11-28-19-20(25)27-22-23(19)16-6-8-17(26-3)9-7-16/h4-9,12H,10-11H2,1-3H3,(H-,21,22,24,25) | Cc1ccc(cc1C)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252193 | 399.463 | C20 H21 N3 O4 S | TWHWUSLBCTZUMM-UHFFFAOYSA-N | InChI=1S/C20H21N3O4S/c1-13-10-14(2)12-15(11-13)21-18(24)8-9-28-19-20(25)27-22-23(19)16-4-6-17(26-3)7-5-16/h4-7,10-12H,8-9H2,1-3H3,(H-,21,22,24,25) | Cc1cc(cc(c1)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005250160 | 383.398 | C20 H21 N3 O5 | UHBDUHXNOFLGKU-UHFFFAOYSA-N | InChI=1S/C20H21N3O5/c1-3-4-13-27-17-9-5-14(6-10-17)21-19(24)18-20(25)28-22-23(18)15-7-11-16(26-2)12-8-15/h5-12H,3-4,13H2,1-2H3,(H-,21,22,24,25) | CCCCOc1ccc(cc1)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251798 | 415.463 | C20 H21 N3 O5 S | UMBLPWCUPIWZCW-UHFFFAOYSA-N | InChI=1S/C20H21N3O5S/c1-4-27-17-8-6-5-7-16(17)21-18(24)13(2)29-19-20(25)28-22-23(19)14-9-11-15(26-3)12-10-14/h5-13H,4H2,1-3H3,(H-,21,22,24,25) | CCOc1ccccc1NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251799 | 415.463 | C20 H21 N3 O5 S | VNQULJADCWIOCP-UHFFFAOYSA-N | InChI=1S/C20H21N3O5S/c1-4-27-17-9-5-14(6-10-17)21-18(24)13(2)29-19-20(25)28-22-23(19)15-7-11-16(26-3)12-8-15/h5-13H,4H2,1-3H3,(H-,21,22,24,25) | CCOc1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252047 | 415.463 | C20 H21 N3 O5 S | MDVOSHVRPZDWFJ-UHFFFAOYSA-N | InChI=1S/C20H21N3O5S/c1-4-17(18(24)21-13-6-5-7-16(12-13)27-3)29-19-20(25)28-22-23(19)14-8-10-15(26-2)11-9-14/h5-12,17H,4H2,1-3H3,(H-,21,22,24,25) | CCC(C(=O)Nc1cccc(c1)OC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252053 | 415.463 | C20 H21 N3 O5 S | RIHLDXSJZJAHAA-UHFFFAOYSA-N | InChI=1S/C20H21N3O5S/c1-4-17(18(24)21-15-11-10-14(26-2)12-16(15)27-3)29-19-20(25)28-22-23(19)13-8-6-5-7-9-13/h5-12,17H,4H2,1-3H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc(cc1OC)OC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252056 | 415.463 | C20 H21 N3 O5 S | IBTSJKXIKBYOPL-UHFFFAOYSA-N | InChI=1S/C20H21N3O5S/c1-4-17(18(24)21-13-5-9-15(26-2)10-6-13)29-19-20(25)28-22-23(19)14-7-11-16(27-3)12-8-14/h5-12,17H,4H2,1-3H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccc(cc1)OC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252062 | 415.463 | C20 H21 N3 O5 S | YOOUFDNEJHONCP-UHFFFAOYSA-N | InChI=1S/C20H21N3O5S/c1-4-17(18(24)21-15-12-14(26-2)10-11-16(15)27-3)29-19-20(25)28-22-23(19)13-8-6-5-7-9-13/h5-12,17H,4H2,1-3H3,(H-,21,22,24,25) | CCC(C(=O)Nc1cc(ccc1OC)OC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252077 | 415.463 | C20 H21 N3 O5 S | SYNASUXBRGTMHO-UHFFFAOYSA-N | InChI=1S/C20H21N3O5S/c1-4-17(18(24)21-13-10-15(26-2)12-16(11-13)27-3)29-19-20(25)28-22-23(19)14-8-6-5-7-9-14/h5-12,17H,4H2,1-3H3,(H-,21,22,24,25) | CCC(C(=O)Nc1cc(cc(c1)OC)OC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252102 | 415.463 | C20 H21 N3 O5 S | NZMFIFQDTWOQHV-UHFFFAOYSA-N | InChI=1S/C20H21N3O5S/c1-4-17(18(24)21-15-7-5-6-8-16(15)27-3)29-19-20(25)28-22-23(19)13-9-11-14(26-2)12-10-13/h5-12,17H,4H2,1-3H3,(H-,21,22,24,25) | CCC(C(=O)Nc1ccccc1OC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252227 | 415.463 | C20 H21 N3 O5 S | OSMMOFMZGBHMQW-UHFFFAOYSA-N | InChI=1S/C20H21N3O5S/c1-3-27-17-7-5-4-6-16(17)21-18(24)12-13-29-19-20(25)28-22-23(19)14-8-10-15(26-2)11-9-14/h4-11H,3,12-13H2,1-2H3,(H-,21,22,24,25) | CCOc1ccccc1NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252228 | 415.463 | C20 H21 N3 O5 S | SDVPUXZYGZKTAJ-UHFFFAOYSA-N | InChI=1S/C20H21N3O5S/c1-3-27-17-8-4-14(5-9-17)21-18(24)12-13-29-19-20(25)28-22-23(19)15-6-10-16(26-2)11-7-15/h4-11H,3,12-13H2,1-2H3,(H-,21,22,24,25) | CCOc1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250213 | 399.397 | C20 H21 N3 O6 | SHMPUPXSGLQHTJ-UHFFFAOYSA-N | InChI=1S/C20H21N3O6/c1-26-15-7-5-14(6-8-15)23-18(20(25)29-22-23)19(24)21-11-10-13-4-9-16(27-2)17(12-13)28-3/h4-9,12H,10-11H2,1-3H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NCCc3ccc(c(c3)OC)OC | |
| AKOS005250271 | 399.397 | C20 H21 N3 O6 | XMHVFXGHGWDMMK-UHFFFAOYSA-N | InChI=1S/C20H21N3O6/c1-22(19(24)13-5-10-17(27-3)18(11-13)28-4)12-16-20(25)29-21-23(16)14-6-8-15(26-2)9-7-14/h5-11H,12H2,1-4H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)c3ccc(c(c3)OC)OC | |
| AKOS005250327 | 399.397 | C20 H21 N3 O6 | XMSBBEACIHNDNX-UHFFFAOYSA-N | InChI=1S/C20H21N3O6/c1-22(19(24)18-16(27-3)6-5-7-17(18)28-4)12-15-20(25)29-21-23(15)13-8-10-14(26-2)11-9-13/h5-11H,12H2,1-4H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)c3c(cccc3OC)OC | |
| AKOS005251812 | 431.462 | C20 H21 N3 O6 S | OEZDHOLBKIHECP-UHFFFAOYSA-N | InChI=1S/C20H21N3O6S/c1-12(18(24)21-16-10-9-15(27-3)11-17(16)28-4)30-19-20(25)29-22-23(19)13-5-7-14(26-2)8-6-13/h5-12H,1-4H3,(H-,21,22,24,25) | CC(C(=O)Nc1ccc(cc1OC)OC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251813 | 431.462 | C20 H21 N3 O6 S | MJVYXRWHMLCCPK-UHFFFAOYSA-N | InChI=1S/C20H21N3O6S/c1-12(18(24)21-16-11-15(27-3)9-10-17(16)28-4)30-19-20(25)29-22-23(19)13-5-7-14(26-2)8-6-13/h5-12H,1-4H3,(H-,21,22,24,25) | CC(C(=O)Nc1cc(ccc1OC)OC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251820 | 431.462 | C20 H21 N3 O6 S | BAHKEQJDNFRQQO-UHFFFAOYSA-N | InChI=1S/C20H21N3O6S/c1-12(18(24)21-13-9-16(27-3)11-17(10-13)28-4)30-19-20(25)29-22-23(19)14-5-7-15(26-2)8-6-14/h5-12H,1-4H3,(H-,21,22,24,25) | CC(C(=O)Nc1cc(cc(c1)OC)OC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252171 | 431.462 | C20 H21 N3 O6 S | IRSNRAAEDHPXKH-UHFFFAOYSA-N | InChI=1S/C20H21N3O6S/c1-26-14-6-4-13(5-7-14)23-19(20(25)29-22-23)30-11-10-18(24)21-16-9-8-15(27-2)12-17(16)28-3/h4-9,12H,10-11H2,1-3H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3OC)OC | |
| AKOS005252172 | 431.462 | C20 H21 N3 O6 S | HQFDJYYWLFXIGL-UHFFFAOYSA-N | InChI=1S/C20H21N3O6S/c1-26-14-6-4-13(5-7-14)23-19(20(25)29-22-23)30-11-10-18(24)21-16-12-15(27-2)8-9-17(16)28-3/h4-9,12H,10-11H2,1-3H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cc(ccc3OC)OC | |
| AKOS005252179 | 431.462 | C20 H21 N3 O6 S | MPIBTSJKJJWLGO-UHFFFAOYSA-N | InChI=1S/C20H21N3O6S/c1-26-15-6-4-14(5-7-15)23-19(20(25)29-22-23)30-9-8-18(24)21-13-10-16(27-2)12-17(11-13)28-3/h4-7,10-12H,8-9H2,1-3H3,(H-,21,22,24,25) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cc(cc(c3)OC)OC | |
| AKOS005253453 | 443.476 | C20 H21 N5 O5 S | XTIJJSNXGPHDOC-UHFFFAOYSA-N | InChI=1S/C20H21N5O5S/c1-11(26)12-3-5-13(6-4-12)21-17(27)9-15-18(28)25(14-7-8-14)20(31)24(15)10-16-19(29)30-22-23(16)2/h3-6,14-15H,7-10H2,1-2H3,(H-,21,22,26,27,29) | CC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])C4CC4 | |
| AKOS005253454 | 459.476 | C20 H21 N5 O6 S | TWVMSVOOMOYOJL-UHFFFAOYSA-N | InChI=1S/C20H21N5O6S/c1-23-15(19(29)31-22-23)10-24-14(17(27)25(20(24)32)13-7-8-13)9-16(26)21-12-5-3-11(4-6-12)18(28)30-2/h3-6,13-14H,7-10H2,1-2H3,(H-,21,22,26,28,29) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C3CC3)CC(=O)Nc4ccc(cc4)C(=O)OC | |
| AKOS005219454 | 350.414 | C20 H22 N4 O2 | ILMIRMZUZLNQOL-UHFFFAOYSA-N | InChI=1S/C20H22N4O2/c1-15(2)24-18(14-21-13-16-9-5-3-6-10-16)20(26-23-24)22-19(25)17-11-7-4-8-12-17/h3-12,15,21H,13-14H2,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CNCc3ccccc3 | |
| AKOS005215424 | 386.875 | C20 H22 N4 O2 . Cl H | YFPVKNZVPFVATG-UHFFFAOYSA-N | InChI=1S/C20H22N4O2.ClH/c1-15(2)24-18(14-21-13-16-9-5-3-6-10-16)20(26-23-24)22-19(25)17-11-7-4-8-12-17;/h3-12,15,21H,13-14H2,1-2H3;1H | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CNCc3ccccc3.Cl | |
| AKOS005250100 | 398.479 | C20 H22 N4 O3 S | JLOJPZDYFIANSR-UHFFFAOYSA-N | InChI=1S/C20H22N4O3S/c1-3-21-20(28)23(13-15-7-5-4-6-8-15)14-18-19(25)27-22-24(18)16-9-11-17(26-2)12-10-16/h4-12H,3,13-14H2,1-2H3,(H-,21,22,25,28) | CCNC(=S)N(Cc1ccccc1)Cc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251339 | 414.412 | C20 H22 N4 O6 | QKLMQLOQMOGLTP-UHFFFAOYSA-N | InChI=1S/C20H22N4O6/c1-3-29-19(27)12-4-6-14(7-5-12)24-17(25)10-15(18(24)26)23(13-8-9-13)11-16-20(28)30-21-22(16)2/h4-7,13,15H,3,8-11H2,1-2H3 | CCOC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)N(Cc3c(on[n+]3C)[O-])C4CC4 | |
| AKOS005253117 | 426.492 | C20 H22 N6 O3 S | XTCHAOQTCJEHPO-UHFFFAOYSA-N | InChI=1S/C20H22N6O3S/c27-17(22-18-12-25(23-29-18)24-10-4-1-5-11-24)13-30-20-21-16-7-3-2-6-15(16)19(28)26(20)14-8-9-14/h2-3,6-7,12,14H,1,4-5,8-11,13H2 | c1ccc2c(c1)c(=O)n(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)C5CC5 | |
| AKOS005253486 | 458.491 | C20 H22 N6 O5 S | LVWGGRFONVTTES-UHFFFAOYSA-N | InChI=1S/C20H22N6O5S/c1-11(27)21-12-3-5-13(6-4-12)22-17(28)9-15-18(29)26(14-7-8-14)20(32)25(15)10-16-19(30)31-23-24(16)2/h3-6,14-15,23,30H,7-10H2,1-2H3 | CC(=O)Nc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])C4CC4 | |
| AKOS005214845 | 369.414 | C20 H23 N3 O4 | VUGFCOUKVQBCCI-UHFFFAOYSA-N | InChI=1S/C20H23N3O4/c1-14-4-7-16(8-5-14)23-17(20(24)27-22-23)13-21-11-10-15-6-9-18(25-2)19(12-15)26-3/h4-9,12,21H,10-11,13H2,1-3H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccc(c(c3)OC)OC | |
| AKOS005214842 | 385.414 | C20 H23 N3 O5 | BZVWRAPPEPXKMD-UHFFFAOYSA-N | InChI=1S/C20H23N3O5/c1-25-16-7-5-15(6-8-16)23-17(20(24)28-22-23)13-21-11-10-14-4-9-18(26-2)19(12-14)27-3/h4-9,12,21H,10-11,13H2,1-3H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNCCc3ccc(c(c3)OC)OC | |
| AKOS005251282 | 465.543 | C20 H23 N3 O6 S2 | BXFOZNFISZDLKG-UHFFFAOYSA-N | InChI=1S/C20H23N3O6S2/c1-3-28-18(25)13-8-10-22(11-9-13)20(30)31-12-16(24)17-19(26)29-21-23(17)14-4-6-15(27-2)7-5-14/h4-7,13H,3,8-12H2,1-2H3 | CCOC(=O)C1CCN(CC1)C(=S)SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005253494 | 445.492 | C20 H23 N5 O5 S | XVZJZIHQBSNDGJ-UHFFFAOYSA-N | InChI=1S/C20H23N5O5S/c1-3-29-14-8-4-12(5-9-14)21-17(26)10-15-18(27)25(13-6-7-13)20(31)24(15)11-16-19(28)30-22-23(16)2/h4-5,8-9,13,15H,3,6-7,10-11H2,1-2H3,(H-,21,22,26,28) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])C4CC4 | |
| AKOS005250932 | 429.427 | C20 H23 N5 O6 | JHQOZZLKSAEXTG-UHFFFAOYSA-O | InChI=1S/C20H22N5O6/c1-3-30-20(29)25-11-9-24(10-12-25)18(27)15(13-16-19(28)31-22-23(16)2)21-17(26)14-7-5-4-6-8-14/h4-8,13H,3,9-12H2,1-2H3/q-1/p+1 | CCOC(=O)N1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2C)[O-])/NC(=O)c3ccccc3 | |
| AKOS005253484 | 461.492 | C20 H23 N5 O6 S | JEHXLLQXOYNTKP-UHFFFAOYSA-N | InChI=1S/C20H23N5O6S/c1-4-24-17(27)14(25(20(24)32)11-15-19(29)31-22-23(15)3)10-16(26)21-13-8-6-12(7-9-13)18(28)30-5-2/h6-9,14H,4-5,10-11H2,1-3H3,(H-,21,22,26,28,29) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)C(=O)OCC | |
| AKOS005253884 | 400.495 | C20 H24 N4 O3 S | YXPPHDLTYKCOFW-UHFFFAOYSA-N | InChI=1S/C20H24N4O3S/c1-5-20(2,3)11-6-7-13-10(8-11)9-12-14(21)17(28-18(12)22-13)16(25)15-19(26)27-23-24(15)4/h9,11H,5-8H2,1-4H3,(H2-,21,23,25,26) | CCC(C)(C)C1CCc2c(cc3c(c(sc3n2)C(=O)c4c(on[n+]4C)[O-])N)C1 | |
| AKOS005250928 | 384.429 | C20 H24 N4 O4 | BQBZPSVVAFRXKQ-UHFFFAOYSA-O | InChI=1S/C20H23N4O4/c1-24-17(20(27)28-23-24)13-16(22-18(25)14-9-5-4-6-10-14)19(26)21-15-11-7-2-3-8-12-15/h4-6,9-10,13,15H,2-3,7-8,11-12H2,1H3,(H,21,26)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NC2CCCCCC2)\NC(=O)c3ccccc3 | |
| AKOS005253054 | 412.509 | C20 H24 N6 O2 S | SGGGNEUOYRUFJH-UHFFFAOYSA-N | InChI=1S/C20H24N6O2S/c1-14-5-6-17-15(9-14)10-16(11-21)20(22-17)29-13-18(27)23-19-12-26(24-28-19)25-7-3-2-4-8-25/h10,12,14H,2-9,13H2,1H3 | CC1CCc2c(cc(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)C#N)C1 | |
| AKOS005253160 | 412.509 | C20 H24 N6 O2 S | FSERZLFWTNVYMM-UHFFFAOYSA-N | InChI=1S/C20H24N6O2S/c21-12-16-11-15-7-3-1-4-8-17(15)22-20(16)29-14-18(27)23-19-13-26(24-28-19)25-9-5-2-6-10-25/h11,13H,1-10,14H2 | c1c2c(nc(c1C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)CCCCC2 | |
| AKOS005252988 | 428.508 | C20 H24 N6 O3 S | YHCZKRGCZBICJA-UHFFFAOYSA-N | InChI=1S/C20H24N6O3S/c21-12-16-11-15-5-3-1-2-4-6-17(15)22-20(16)30-14-18(27)23-19-13-26(24-29-19)25-7-9-28-10-8-25/h11,13H,1-10,14H2 | c1c2c(nc(c1C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)CCCCCC2 | |
| AKOS005250298 | 371.43 | C20 H25 N3 O4 | CQLBFXJNVURIHN-UHFFFAOYSA-N | InChI=1S/C20H25N3O4/c1-26-17-11-9-16(10-12-17)23-18(20(25)27-21-23)13-22(15-7-8-15)19(24)14-5-3-2-4-6-14/h9-12,14-15H,2-8,13H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)C4CCCCC4 | |
| AKOS005252506 | 399.51 | C20 H25 N5 O2 S | IWTNRJFGFHKFHG-UHFFFAOYSA-N | InChI=1S/C20H25N5O2S/c1-5-25-11-18(27-24-25)23-17(26)12-28-19-14(10-21)8-13-9-15(20(2,3)4)6-7-16(13)22-19/h8,11,15H,5-7,9,12H2,1-4H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCC(C3)C(C)(C)C)C#N | |
| AKOS005251939 | 479.573 | C20 H25 N5 O5 S2 | KZBBADCRTASOCC-UHFFFAOYSA-N | InChI=1S/C20H25N5O5S2/c1-6-13(32-17-18(27)30-23-24(17)5)15(26)22-16-12(9-21)11-7-8-25(10-14(11)31-16)19(28)29-20(2,3)4/h13H,6-8,10H2,1-5H3,(H-,22,23,26,27) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)OC(C)(C)C)C#N)Sc3c(on[n+]3C)[O-] | |
| AKOS005251952 | 434.575 | C20 H26 N4 O3 S2 | MTKPSVZDOACBFH-UHFFFAOYSA-N | InChI=1S/C20H26N4O3S2/c1-6-14(29-18-19(26)27-23-24(18)5)16(25)22-17-13(10-21)12-8-7-11(20(2,3)4)9-15(12)28-17/h11,14H,6-9H2,1-5H3,(H-,22,23,25,26) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C(C)(C)C)C#N)Sc3c(on[n+]3C)[O-] | |
| AKOS005251579 | 498.573 | C20 H26 N4 O7 S2 | GCQUUFWVRKVFQM-UHFFFAOYSA-N | InChI=1S/C20H26N4O7S2/c1-6-29-17(26)14-11-7-8-24(19(28)30-20(2,3)4)9-12(11)33-15(14)21-13(25)10-32-16-18(27)31-22-23(16)5/h6-10H2,1-5H3,(H-,21,22,25,26,27) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3C)[O-])CN(CC2)C(=O)OC(C)(C)C | |
| AKOS005251761 | 498.573 | C20 H26 N4 O7 S2 | VRGSGHCFVWVLIE-UHFFFAOYSA-N | InChI=1S/C20H26N4O7S2/c1-10(32-16-18(27)31-22-23(16)5)14(25)21-15-13(17(26)29-6)11-7-8-24(9-12(11)33-15)19(28)30-20(2,3)4/h10H,7-9H2,1-6H3,(H-,21,22,25,26,27) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)OC(C)(C)C)C(=O)OC)Sc3c(on[n+]3C)[O-] | |
| AKOS005252648 | 498.573 | C20 H26 N4 O7 S2 | YYQRDAGTYCSVHD-UHFFFAOYSA-N | InChI=1S/C20H26N4O7S2/c1-20(2,3)30-19(28)24-8-6-11-12(10-24)33-15(14(11)17(26)29-5)21-13(25)7-9-32-16-18(27)31-22-23(16)4/h6-10H2,1-5H3,(H-,21,22,25,26,27) | CC(C)(C)OC(=O)N1CCc2c(sc(c2C(=O)OC)NC(=O)CCSc3c(on[n+]3C)[O-])C1 | |
| AKOS005252713 | 414.524 | C20 H26 N6 O2 S | NXHSTXLLZNDBES-UHFFFAOYSA-N | InChI=1S/C20H26N6O2S/c1-20(2,3)15-6-7-16-13(9-15)8-14(10-21)19(22-16)29-12-17(27)23-18-11-26(24-28-18)25(4)5/h8,11,15H,6-7,9,12H2,1-5H3 | CC(C)(C)C1CCc2c(cc(c(n2)SCC(=O)[N-]c3c[n+](no3)N(C)C)C#N)C1 | |
| AKOS005251609 | 453.575 | C20 H27 N3 O5 S2 | NCDIFOJWONYZBC-UHFFFAOYSA-N | InChI=1S/C20H27N3O5S2/c1-6-27-18(25)15-12-8-7-11(20(2,3)4)9-13(12)30-16(15)21-14(24)10-29-17-19(26)28-22-23(17)5/h11H,6-10H2,1-5H3,(H-,21,22,24,25,26) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3C)[O-])CC(CC2)C(C)(C)C | |
| AKOS005251751 | 453.575 | C20 H27 N3 O5 S2 | VKDIVKZUKYZMPH-UHFFFAOYSA-N | InChI=1S/C20H27N3O5S2/c1-10(29-17-19(26)28-22-23(17)5)15(24)21-16-14(18(25)27-6)12-8-7-11(20(2,3)4)9-13(12)30-16/h10-11H,7-9H2,1-6H3,(H-,21,22,24,25,26) | CC(C(=O)Nc1c(c2c(s1)CC(CC2)C(C)(C)C)C(=O)OC)Sc3c(on[n+]3C)[O-] | |
| AKOS005251967 | 453.575 | C20 H27 N3 O5 S2 | DSQFZEYQONKHDA-UHFFFAOYSA-N | InChI=1S/C20H27N3O5S2/c1-4-13(30-18-20(26)28-22-23(18)3)16(24)21-17-15(19(25)27-5-2)12-10-8-6-7-9-11-14(12)29-17/h13H,4-11H2,1-3H3,(H-,21,22,24,25,26) | CCC(C(=O)Nc1c(c2c(s1)CCCCCC2)C(=O)OCC)Sc3c(on[n+]3C)[O-] | |
| AKOS005252541 | 453.575 | C20 H27 N3 O5 S2 | HDYDOEUKZDZUIY-UHFFFAOYSA-N | InChI=1S/C20H27N3O5S2/c1-20(2,3)11-6-7-12-13(10-11)30-16(15(12)18(25)27-5)21-14(24)8-9-29-17-19(26)28-22-23(17)4/h11H,6-10H2,1-5H3,(H-,21,22,24,25,26) | CC(C)(C)C1CCc2c(sc(c2C(=O)OC)NC(=O)CCSc3c(on[n+]3C)[O-])C1 | |
| AKOS005250817 | 488.462 | C21 H11 F3 N4 O3 S2 | SQEODHFHWMWYKU-UHFFFAOYSA-N | InChI=1S/C21H11F3N4O3S2/c22-21(23,24)14-9-15(17-7-4-8-32-17)26-19(13(14)10-25)33-11-16(29)18-20(30)31-27-28(18)12-5-2-1-3-6-12/h1-9H,11H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(c(cc(n3)c4cccs4)C(F)(F)F)C#N | |
| AKOS005253674 | 488.462 | C21 H11 F3 N4 O3 S2 | SQQKZKOVBJPTRH-UHFFFAOYSA-N | InChI=1S/C21H11F3N4O3S2/c22-21(23,24)11-9-12(13-7-4-8-32-13)26-19-14(11)15(25)18(33-19)17(29)16-20(30)31-27-28(16)10-5-2-1-3-6-10/h1-9H,(H2-,25,27,29,30) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5cccs5)C(F)(F)F)N | |
| AKOS005250397 | 421.856 | C21 H12 Cl N3 O3 S | MGMZFEGXPNUNAA-UHFFFAOYSA-N | InChI=1S/C21H12ClN3O3S/c22-13-10-11-18-16(12-13)24(15-8-4-5-9-17(15)29-18)20(26)19-21(27)28-23-25(19)14-6-2-1-3-7-14/h1-12H | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3c4ccccc4Sc5c3cc(cc5)Cl | |
| AKOS005250834 | 460.488 | C21 H12 N6 O3 S2 | PFQOYRNUBUBWLS-UHFFFAOYSA-N | InChI=1S/C21H12N6O3S2/c22-9-13-17(16-7-4-8-31-16)14(10-23)20(25-19(13)24)32-11-15(28)18-21(29)30-26-27(18)12-5-2-1-3-6-12/h1-8H,11H2,(H2-,24,25,26,28,29) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(c(c(c(n3)N)C#N)c4cccs4)C#N | |
| AKOS005253735 | 460.488 | C21 H12 N6 O3 S2 | YUIWPFDLIJBMNR-UHFFFAOYSA-N | InChI=1S/C21H12N6O3S2/c22-9-11-13(12-7-4-8-31-12)14-15(23)18(32-20(14)25-19(11)24)17(28)16-21(29)30-26-27(16)10-5-2-1-3-6-10/h1-8H,(H4-,23,24,25,26,28,29) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(c(c(nc4s3)N)C#N)c5cccs5)N | |
| AKOS005253766 | 460.488 | C21 H12 N6 O3 S2 | CDCNVSBKUUYUIV-UHFFFAOYSA-N | InChI=1S/C21H12N6O3S2/c22-8-12-13(10-6-7-31-9-10)14-15(23)18(32-20(14)25-19(12)24)17(28)16-21(29)30-26-27(16)11-4-2-1-3-5-11/h1-7,9H,(H4-,23,24,25,26,28,29) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(c(c(nc4s3)N)C#N)c5ccsc5)N | |
| AKOS005250839 | 444.423 | C21 H12 N6 O4 S | DMYKFVLRZBDJTN-UHFFFAOYSA-N | InChI=1S/C21H12N6O4S/c22-9-13-17(16-7-4-8-30-16)14(10-23)20(25-19(13)24)32-11-15(28)18-21(29)31-26-27(18)12-5-2-1-3-6-12/h1-8H,11H2,(H2-,24,25,26,28,29) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(c(c(c(n3)N)C#N)c4ccco4)C#N | |
| AKOS005253719 | 444.423 | C21 H12 N6 O4 S | XLFGMJYNMOTDNU-UHFFFAOYSA-N | InChI=1S/C21H12N6O4S/c22-9-11-13(12-7-4-8-30-12)14-15(23)18(32-20(14)25-19(11)24)17(28)16-21(29)31-26-27(16)10-5-2-1-3-6-10/h1-8H,(H4-,23,24,25,26,28,29) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(c(c(nc4s3)N)C#N)c5ccco5)N | |
| AKOS005250494 | 387.411 | C21 H13 N3 O3 S | XFRHMKHZQSBHSX-UHFFFAOYSA-N | InChI=1S/C21H13N3O3S/c25-20(19-21(26)27-22-24(19)14-8-2-1-3-9-14)23-15-10-4-6-12-17(15)28-18-13-7-5-11-16(18)23/h1-13H | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3c4ccccc4Sc5c3cccc5 | |
| AKOS005250715 | 472.877 | C21 H14 Cl F N4 O4 S | MQIATPWLYADSGA-YBEGLDIGSA-N | InChI=1S/C21H14ClFN4O4S/c1-26-18(20(30)31-25-26)17(28)11-32-21-24-16(10-13-14(22)8-5-9-15(13)23)19(29)27(21)12-6-3-2-4-7-12/h2-10H,11H2,1H3/b16-10- | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C\c3c(cccc3Cl)F)/C(=O)N2c4ccccc4 | |
| AKOS005215649 | 375.808 | C21 H14 Cl N3 O2 | KLNGCYSYCAXZFL-UHFFFAOYSA-N | InChI=1S/C21H14ClN3O2/c22-17-10-6-15(7-11-17)14-23-18-12-8-16(9-13-18)20-21(26)27-24-25(20)19-4-2-1-3-5-19/h1-14H | c1ccc(cc1)[n+]2c(c(on2)[O-])c3ccc(cc3)/N=C/c4ccc(cc4)Cl | |
| AKOS005250736 | 489.331 | C21 H14 Cl2 N4 O4 S | MZMBLOBYZROXMP-XNTDXEJSSA-N | InChI=1S/C21H14Cl2N4O4S/c1-26-18(20(30)31-25-26)16(28)11-32-21-24-15(10-12-6-5-9-14(22)17(12)23)19(29)27(21)13-7-3-2-4-8-13/h2-10H,11H2,1H3/b15-10+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3cccc(c3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005250737 | 489.331 | C21 H14 Cl2 N4 O4 S | OHCKMCYIMASJJN-CXUHLZMHSA-N | InChI=1S/C21H14Cl2N4O4S/c1-26-18(20(30)31-25-26)17(28)11-32-21-24-16(9-12-7-8-13(22)10-15(12)23)19(29)27(21)14-5-3-2-4-6-14/h2-10H,11H2,1H3/b16-9+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3ccc(cc3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005250743 | 489.331 | C21 H14 Cl2 N4 O4 S | PPVDLJYTAZTOFP-YBEGLDIGSA-N | InChI=1S/C21H14Cl2N4O4S/c1-26-18(20(30)31-25-26)17(28)11-32-21-24-16(10-13-14(22)8-5-9-15(13)23)19(29)27(21)12-6-3-2-4-7-12/h2-10H,11H2,1H3/b16-10- | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C\c3c(cccc3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005253512 | 458.453 | C21 H14 N8 O3 S | ZFHYOAPTAYBXPL-UHFFFAOYSA-N | InChI=1S/C21H14N8O3S/c1-29-16(21(31)32-28-29)13-10(8-22)18(24)27-20-14(13)15(23)17(33-20)19(30)26-12-6-2-5-11-9(12)4-3-7-25-11/h2-7H,1H3,(H5-,23,24,25,26,27,28,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4cccc5c4cccn5)N)N)C#N | |
| AKOS005253578 | 458.453 | C21 H14 N8 O3 S | LGUZECKPMAYZMR-UHFFFAOYSA-N | InChI=1S/C21H14N8O3S/c1-29-18(21(31)32-28-29)17-12(8-22)19(24)27-20(13(17)9-23)33-10-16(30)26-15-6-2-5-14-11(15)4-3-7-25-14/h2-7H,10H2,1H3,(H3-,24,25,26,27,28,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3cccc4c3cccn4)N)C#N | |
| AKOS005251088 | 499.337 | C21 H15 Br N4 O4 S | XWYPABAKFXFTHC-LFIBNONCSA-N | InChI=1S/C21H15BrN4O4S/c1-25-18(20(29)30-24-25)17(27)12-31-21-23-16(11-13-6-5-7-14(22)10-13)19(28)26(21)15-8-3-2-4-9-15/h2-11H,12H2,1H3/b16-11+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3cccc(c3)Br)/C(=O)N2c4ccccc4 | |
| AKOS005251095 | 499.337 | C21 H15 Br N4 O4 S | WRXNRMJXJGLWRD-LFIBNONCSA-N | InChI=1S/C21H15BrN4O4S/c1-25-18(20(29)30-24-25)17(27)12-31-21-23-16(11-13-7-9-14(22)10-8-13)19(28)26(21)15-5-3-2-4-6-15/h2-11H,12H2,1H3/b16-11+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3ccc(cc3)Br)/C(=O)N2c4ccccc4 | |
| AKOS005252420 | 471.892 | C21 H15 Cl F N5 O3 S | WSKMJTVTULVRFE-YVLHZVERSA-N | InChI=1S/C21H15ClFN5O3S/c1-27-11-19(31-26-27)25-18(29)12-32-21-24-17(10-14-15(22)8-5-9-16(14)23)20(30)28(21)13-6-3-2-4-7-13/h2-11H,12H2,1H3/b17-10- | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C\c3c(cccc3Cl)F)/C(=O)N2c4ccccc4 | |
| AKOS005250721 | 454.886 | C21 H15 Cl N4 O4 S | GDMVOTLEIOTTHL-LFIBNONCSA-N | InChI=1S/C21H15ClN4O4S/c1-25-18(20(29)30-24-25)17(27)12-31-21-23-16(11-13-7-5-6-10-15(13)22)19(28)26(21)14-8-3-2-4-9-14/h2-11H,12H2,1H3/b16-11+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3ccccc3Cl)/C(=O)N2c4ccccc4 | |
| AKOS005250722 | 454.886 | C21 H15 Cl N4 O4 S | PVUZPPDTAHKFHI-LFIBNONCSA-N | InChI=1S/C21H15ClN4O4S/c1-25-18(20(29)30-24-25)17(27)12-31-21-23-16(11-13-6-5-7-14(22)10-13)19(28)26(21)15-8-3-2-4-9-15/h2-11H,12H2,1H3/b16-11+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3cccc(c3)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005250729 | 454.886 | C21 H15 Cl N4 O4 S | BMDPYXJWCWCPDM-LFIBNONCSA-N | InChI=1S/C21H15ClN4O4S/c1-25-18(20(29)30-24-25)17(27)12-31-21-23-16(11-13-7-9-14(22)10-8-13)19(28)26(21)15-5-3-2-4-6-15/h2-11H,12H2,1H3/b16-11+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3ccc(cc3)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252425 | 488.346 | C21 H15 Cl2 N5 O3 S | UWUNBZKCVLBKHT-MHWRWJLKSA-N | InChI=1S/C21H15Cl2N5O3S/c1-27-11-18(31-26-27)25-17(29)12-32-21-24-16(10-13-6-5-9-15(22)19(13)23)20(30)28(21)14-7-3-2-4-8-14/h2-11H,12H2,1H3/b16-10+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252426 | 488.346 | C21 H15 Cl2 N5 O3 S | SFHWTXIWBJBXPC-RQZCQDPDSA-N | InChI=1S/C21H15Cl2N5O3S/c1-27-11-19(31-26-27)25-18(29)12-32-21-24-17(9-13-7-8-14(22)10-16(13)23)20(30)28(21)15-5-3-2-4-6-15/h2-11H,12H2,1H3/b17-9+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252427 | 488.346 | C21 H15 Cl2 N5 O3 S | XKPJSNPAANCAEV-YVLHZVERSA-N | InChI=1S/C21H15Cl2N5O3S/c1-27-11-19(31-26-27)25-18(29)12-32-21-24-17(10-14-15(22)8-5-9-16(14)23)20(30)28(21)13-6-3-2-4-7-13/h2-11H,12H2,1H3/b17-10- | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C\c3c(cccc3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005250692 | 438.432 | C21 H15 F N4 O4 S | HSDPPWMWWRPNBA-LFIBNONCSA-N | InChI=1S/C21H15FN4O4S/c1-25-18(20(29)30-24-25)17(27)12-31-21-23-16(11-13-7-9-14(22)10-8-13)19(28)26(21)15-5-3-2-4-6-15/h2-11H,12H2,1H3/b16-11+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3ccc(cc3)F)/C(=O)N2c4ccccc4 | |
| AKOS005250753 | 438.432 | C21 H15 F N4 O4 S | YSCQYKLLMLRASQ-LFIBNONCSA-N | InChI=1S/C21H15FN4O4S/c1-25-18(20(29)30-24-25)17(27)12-31-21-23-16(11-13-7-5-6-10-15(13)22)19(28)26(21)14-8-3-2-4-9-14/h2-11H,12H2,1H3/b16-11+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3ccccc3F)/C(=O)N2c4ccccc4 | |
| AKOS005252452 | 498.352 | C21 H16 Br N5 O3 S | UYRLHZCZCAUKAK-GZTJUZNOSA-N | InChI=1S/C21H16BrN5O3S/c1-26-12-19(30-25-26)24-18(28)13-31-21-23-17(11-14-6-5-7-15(22)10-14)20(29)27(21)16-8-3-2-4-9-16/h2-12H,13H2,1H3/b17-11+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3)Br)/C(=O)N2c4ccccc4 | |
| AKOS005252460 | 498.352 | C21 H16 Br N5 O3 S | PHOIWCUAGNSMST-GZTJUZNOSA-N | InChI=1S/C21H16BrN5O3S/c1-26-12-19(30-25-26)24-18(28)13-31-21-23-17(11-14-7-9-15(22)10-8-14)20(29)27(21)16-5-3-2-4-6-16/h2-12H,13H2,1H3/b17-11+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)Br)/C(=O)N2c4ccccc4 | |
| AKOS005252421 | 453.901 | C21 H16 Cl N5 O3 S | PQLPYDDHYCLLDF-GZTJUZNOSA-N | InChI=1S/C21H16ClN5O3S/c1-26-12-19(30-25-26)24-18(28)13-31-21-23-17(11-14-7-5-6-10-16(14)22)20(29)27(21)15-8-3-2-4-9-15/h2-12H,13H2,1H3/b17-11+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252422 | 453.901 | C21 H16 Cl N5 O3 S | QHZHIMFTNCCYIG-GZTJUZNOSA-N | InChI=1S/C21H16ClN5O3S/c1-26-12-19(30-25-26)24-18(28)13-31-21-23-17(11-14-6-5-7-15(22)10-14)20(29)27(21)16-8-3-2-4-9-16/h2-12H,13H2,1H3/b17-11+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252423 | 453.901 | C21 H16 Cl N5 O3 S | VVTICCFKEQQNGM-GZTJUZNOSA-N | InChI=1S/C21H16ClN5O3S/c1-26-12-19(30-25-26)24-18(28)13-31-21-23-17(11-14-7-9-15(22)10-8-14)20(29)27(21)16-5-3-2-4-6-16/h2-12H,13H2,1H3/b17-11+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252467 | 437.447 | C21 H16 F N5 O3 S | YMJBTPBWXODTPA-GZTJUZNOSA-N | InChI=1S/C21H16FN5O3S/c1-26-12-19(30-25-26)24-18(28)13-31-21-23-17(11-14-7-5-6-10-16(14)22)20(29)27(21)15-8-3-2-4-9-15/h2-12H,13H2,1H3/b17-11+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3F)/C(=O)N2c4ccccc4 | |
| AKOS005252475 | 437.447 | C21 H16 F N5 O3 S | AAJFNLFLJBORKJ-GZTJUZNOSA-N | InChI=1S/C21H16FN5O3S/c1-26-12-19(30-25-26)24-18(28)13-31-21-23-17(11-14-7-9-15(22)10-8-14)20(29)27(21)16-5-3-2-4-6-16/h2-12H,13H2,1H3/b17-11+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)F)/C(=O)N2c4ccccc4 | |
| AKOS003578259 | 344.363 | C21 H16 N2 O3 | BEGKVIQCSYBYRS-UHFFFAOYSA-N | InChI=1S/C21H16N2O3/c24-20-19(23(22-26-20)18-14-8-3-9-15-18)21(25,16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-15,25H | c1ccc(cc1)C(c2ccccc2)(c3c(on[n+]3c4ccccc4)[O-])O | MFCD03211601 |
| AKOS005250673 | 420.441 | C21 H16 N4 O4 S | KRKPPHKDKPWLII-UHFFFAOYSA-N | InChI=1S/C21H16N4O4S/c26-17(18-20(28)29-23-25(18)14-6-2-1-3-7-14)12-30-21-22-16-9-5-4-8-15(16)19(27)24(21)13-10-11-13/h1-9,13H,10-12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nc4ccccc4c(=O)n3C5CC5 | |
| AKOS005251096 | 420.441 | C21 H16 N4 O4 S | ZWEZBSPVLYRGNP-FOWTUZBSSA-N | InChI=1S/C21H16N4O4S/c1-24-18(20(28)29-23-24)17(26)13-30-21-22-16(12-14-8-4-2-5-9-14)19(27)25(21)15-10-6-3-7-11-15/h2-12H,13H2,1H3/b16-12+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3ccccc3)/C(=O)N2c4ccccc4 | |
| AKOS005250446 | 448.455 | C21 H16 N6 O4 S | CASCOAPEARTAEM-UHFFFAOYSA-N | InChI=1S/C21H16N6O4S/c1-30-13-6-4-12(5-7-13)27-18(21(29)31-26-27)16(28)10-32-20-15(9-23)17(11-2-3-11)14(8-22)19(24)25-20/h4-7,11H,2-3,10H2,1H3,(H2-,24,25,26,28,29) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(c(c(c(n3)N)C#N)C4CC4)C#N | |
| AKOS005253242 | 460.469 | C21 H16 N8 O3 S | CVNVQESMQPMXEJ-UHFFFAOYSA-N | InChI=1S/C21H16N8O3S/c1-10(19(30)26-12-3-4-15-11(7-12)5-6-25-15)33-20-14(9-23)16(13(8-22)18(24)27-20)17-21(31)32-28-29(17)2/h3-7,10,28H,1-2H3,(H3,24,27,31) | CC(C(=O)Nc1ccc2c(c1)cc[nH]2)Sc3c(c(c(c(n3)N)C#N)c4c(on[n+]4C)[O-])C#N | |
| AKOS005253904 | 501.353 | C21 H17 Br N4 O4 S | HZTAUKSSOMDFFL-UHFFFAOYSA-N | InChI=1S/C21H17BrN4O4S/c1-9-13(8-14(27)11-4-6-12(22)7-5-11)10(2)24-20-15(9)16(23)19(31-20)18(28)17-21(29)30-25-26(17)3/h4-7H,8H2,1-3H3,(H2-,23,25,28,29) | Cc1c(c(nc2c1c(c(s2)C(=O)c3c(on[n+]3C)[O-])N)C)CC(=O)c4ccc(cc4)Br | |
| AKOS005253280 | 478.378 | C21 H17 F3 N4 O6 | IERKPLKBLATYDO-UHFFFAOYSA-N | InChI=1S/C21H17F3N4O6/c1-32-14-6-4-13(5-7-14)28-17(20(31)34-26-28)11-25-16-10-18(29)27(19(16)30)12-2-8-15(9-3-12)33-21(22,23)24/h2-9,16,25H,10-11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)OC(F)(F)F | |
| AKOS005252949 | 490.458 | C21 H17 F3 N6 O3 S | XYSSYDLBSCKMGA-UHFFFAOYSA-N | InChI=1S/C21H17F3N6O3S/c22-21(23,24)16-10-17(14-4-2-1-3-5-14)26-20(15(16)11-25)34-13-18(31)27-19-12-30(28-33-19)29-6-8-32-9-7-29/h1-5,10,12H,6-9,13H2 | c1ccc(cc1)c2cc(c(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)C#N)C(F)(F)F | |
| AKOS005250262 | 359.378 | C21 H17 N3 O3 | OBNSREHEZADUSH-UHFFFAOYSA-N | InChI=1S/C21H17N3O3/c1-23(20(25)17-12-11-15-7-5-6-8-16(15)13-17)14-19-21(26)27-22-24(19)18-9-3-2-4-10-18/h2-13H,14H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)c3ccc4ccccc4c3 | |
| AKOS005251480 | 391.443 | C21 H17 N3 O3 S | GQKPRDXMHSLCCG-UHFFFAOYSA-N | InChI=1S/C21H17N3O3S/c1-14(19(25)22-17-12-11-15-7-5-6-8-16(15)13-17)28-20-21(26)27-23-24(20)18-9-3-2-4-10-18/h2-14H,1H3,(H-,22,23,25,26) | CC(C(=O)Nc1ccc2ccccc2c1)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251481 | 391.443 | C21 H17 N3 O3 S | FGTZKPCWOVXPPB-UHFFFAOYSA-N | InChI=1S/C21H17N3O3S/c1-14(19(25)22-18-13-7-9-15-8-5-6-12-17(15)18)28-20-21(26)27-23-24(20)16-10-3-2-4-11-16/h2-14H,1H3,(H-,22,23,25,26) | CC(C(=O)Nc1cccc2c1cccc2)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252141 | 391.443 | C21 H17 N3 O3 S | HACANJALWLWPLV-UHFFFAOYSA-N | InChI=1S/C21H17N3O3S/c25-19(22-17-11-10-15-6-4-5-7-16(15)14-17)12-13-28-20-21(26)27-23-24(20)18-8-2-1-3-9-18/h1-11,14H,12-13H2,(H-,22,23,25,26) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc4ccccc4c3 | |
| AKOS005252142 | 391.443 | C21 H17 N3 O3 S | WKBHZKLPTQGJRR-UHFFFAOYSA-N | InChI=1S/C21H17N3O3S/c25-19(22-18-12-6-8-15-7-4-5-11-17(15)18)13-14-28-20-21(26)27-23-24(20)16-9-2-1-3-10-16/h1-12H,13-14H2,(H-,22,23,25,26) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cccc4c3cccc4 | |
| AKOS005251636 | 407.442 | C21 H17 N3 O4 S | QBTOKWOZHPGDFA-UHFFFAOYSA-N | InChI=1S/C21H17N3O4S/c1-27-18-10-8-17(9-11-18)24-20(21(26)28-23-24)29-13-19(25)22-16-7-6-14-4-2-3-5-15(14)12-16/h2-12H,13H2,1H3,(H-,22,23,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc4ccccc4c3 | |
| AKOS005251643 | 407.442 | C21 H17 N3 O4 S | ONFPDBWRXHIVFH-UHFFFAOYSA-N | InChI=1S/C21H17N3O4S/c1-27-16-11-9-15(10-12-16)24-20(21(26)28-23-24)29-13-19(25)22-18-8-4-6-14-5-2-3-7-17(14)18/h2-12H,13H2,1H3,(H-,22,23,25,26) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3cccc4c3cccc4 | |
| AKOS005250783 | 439.507 | C21 H17 N3 O4 S2 | WQBNNCJCUUESJO-UHFFFAOYSA-N | InChI=1S/C21H17N3O4S2/c1-13-3-5-14(6-4-13)17-11-29-21(22-17)30-12-18(25)19-20(26)28-23-24(19)15-7-9-16(27-2)10-8-15/h3-11H,12H2,1-2H3 | Cc1ccc(cc1)c2csc(n2)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005250785 | 455.507 | C21 H17 N3 O5 S2 | WDQJWTJVDKNPFI-UHFFFAOYSA-N | InChI=1S/C21H17N3O5S2/c1-27-15-7-3-13(4-8-15)17-11-30-21(22-17)31-12-18(25)19-20(26)29-23-24(19)14-5-9-16(28-2)10-6-14/h3-11H,12H2,1-2H3 | COc1ccc(cc1)c2csc(n2)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252461 | 419.456 | C21 H17 N5 O3 S | VRIUPHJHBNAWAG-SFQUDFHCSA-N | InChI=1S/C21H17N5O3S/c1-25-13-19(29-24-25)23-18(27)14-30-21-22-17(12-15-8-4-2-5-9-15)20(28)26(21)16-10-6-3-7-11-16/h2-13H,14H2,1H3/b17-12+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3)/C(=O)N2c4ccccc4 | |
| AKOS005253332 | 419.39 | C21 H17 N5 O5 | IKFYUTFHOQNWEI-UHFFFAOYSA-N | InChI=1S/C21H17N5O5/c1-25-16(21(29)31-24-25)11-22-15-10-18(27)26(20(15)28)13-8-6-12(7-9-13)19-23-14-4-2-3-5-17(14)30-19/h2-9,15,22H,10-11H2,1H3 | C[n+]1c(c(on1)[O-])CNC2CC(=O)N(C2=O)c3ccc(cc3)c4nc5ccccc5o4 | |
| AKOS005253045 | 447.47 | C21 H17 N7 O3 S | KQUYXDIRMHSFJW-UHFFFAOYSA-N | InChI=1S/C21H17N7O3S/c29-16(22-17-11-28(26-31-17)27-7-9-30-10-8-27)12-32-21-23-19-14-5-1-3-13-4-2-6-15(18(13)14)20(19)24-25-21/h1-6,11H,7-10,12H2 | c1cc2cccc-3c2c(c1)-c4c3nnc(n4)SCC(=O)[N-]c5c[n+](no5)N6CCOCC6 | |
| AKOS005253230 | 463.469 | C21 H17 N7 O4 S | XXMPDUUVSISCAE-UHFFFAOYSA-N | InChI=1S/C21H17N7O4S/c1-10(29)12-4-6-13(7-5-12)25-19(30)11(2)33-20-15(9-23)16(14(8-22)18(24)26-20)17-21(31)32-27-28(17)3/h4-7,11H,1-3H3,(H3-,24,25,26,27,29,30,31) | CC(C(=O)Nc1ccc(cc1)C(=O)C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253209 | 479.469 | C21 H17 N7 O5 S | QLOBWHXTWMXBRG-UHFFFAOYSA-N | InChI=1S/C21H17N7O5S/c1-10(18(29)25-14-7-5-4-6-11(14)20(30)32-3)34-19-13(9-23)15(12(8-22)17(24)26-19)16-21(31)33-27-28(16)2/h4-7,10H,1-3H3,(H3-,24,25,26,27,29,30,31) | CC(C(=O)Nc1ccccc1C(=O)OC)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253227 | 479.469 | C21 H17 N7 O5 S | VCCZFUCIKQXJKO-UHFFFAOYSA-N | InChI=1S/C21H17N7O5S/c1-10(19(29)25-11-3-4-14-15(7-11)32-6-5-31-14)34-20-13(9-23)16(12(8-22)18(24)26-20)17-21(30)33-27-28(17)2/h3-4,7,10H,5-6H2,1-2H3,(H3-,24,25,26,27,29,30) | CC(C(=O)Nc1ccc2c(c1)OCCO2)Sc3c(c(c(c(n3)N)C#N)c4c(on[n+]4C)[O-])C#N | |
| AKOS005253258 | 479.469 | C21 H17 N7 O5 S | JQSVLIGKLOZYQK-UHFFFAOYSA-N | InChI=1S/C21H17N7O5S/c1-9-4-5-11(20(30)31)6-14(9)25-18(29)10(2)34-19-13(8-23)15(12(7-22)17(24)26-19)16-21(32)33-27-28(16)3/h4-6,10H,1-3H3,(H4-,24,25,26,27,29,30,31,32) | Cc1ccc(cc1NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N)C(=O)O | |
| AKOS005253543 | 479.469 | C21 H17 N7 O5 S | NGMMOHVYZAWDEI-UHFFFAOYSA-N | InChI=1S/C21H17N7O5S/c1-3-32-20(30)9-4-6-10(7-5-9)25-18(29)16-14(23)13-12(15-21(31)33-27-28(15)2)11(8-22)17(24)26-19(13)34-16/h4-7H,3H2,1-2H3,(H5-,23,24,25,26,27,29,30,31) | CCOC(=O)c1ccc(cc1)NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N | |
| AKOS005253667 | 479.469 | C21 H17 N7 O5 S | OHPLUHOTDLPBRE-UHFFFAOYSA-N | InChI=1S/C21H17N7O5S/c1-3-32-20(30)11-4-6-12(7-5-11)25-15(29)10-34-19-14(9-23)16(13(8-22)18(24)26-19)17-21(31)33-27-28(17)2/h4-7H,3,10H2,1-2H3,(H3-,24,25,26,27,29,30,31) | CCOC(=O)c1ccc(cc1)NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253202 | 495.468 | C21 H17 N7 O6 S | CHIXWLHOTCKELL-UHFFFAOYSA-N | InChI=1S/C21H17N7O6S/c1-9(18(29)25-13-5-4-10(20(30)31)6-14(13)33-3)35-19-12(8-23)15(11(7-22)17(24)26-19)16-21(32)34-27-28(16)2/h4-6,9H,1-3H3,(H4-,24,25,26,27,29,30,31,32) | CC(C(=O)Nc1ccc(cc1OC)C(=O)O)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253807 | 516.368 | C21 H18 Br N5 O4 S | MEAVNGGWKFRRDN-UHFFFAOYSA-N | InChI=1S/C21H18BrN5O4S/c1-25-17(20(30)31-24-25)12-26-16(11-18(28)23-14-9-7-13(22)8-10-14)19(29)27(21(26)32)15-5-3-2-4-6-15/h2-10,16H,11-12H2,1H3,(H-,23,24,28,30) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)c3ccccc3)CC(=O)Nc4ccc(cc4)Br | |
| AKOS005253928 | 471.917 | C21 H18 Cl N5 O4 S | UWPAHMCTTVOKMN-UHFFFAOYSA-N | InChI=1S/C21H18ClN5O4S/c1-25-17(20(30)31-24-25)12-26-16(11-18(28)23-14-9-7-13(22)8-10-14)19(29)27(21(26)32)15-5-3-2-4-6-15/h2-10,16H,11-12H2,1H3,(H-,23,24,28,30) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)c3ccccc3)CC(=O)Nc4ccc(cc4)Cl | |
| AKOS005253215 | 499.93 | C21 H18 Cl N7 O4 S | MYVUNYURIDGOAL-UHFFFAOYSA-N | InChI=1S/C21H18ClN7O4S/c1-9-5-14(15(32-4)6-13(9)22)26-19(30)10(2)34-20-12(8-24)16(11(7-23)18(25)27-20)17-21(31)33-28-29(17)3/h5-6,10H,1-4H3,(H3-,25,26,27,28,30,31) | Cc1cc(c(cc1Cl)OC)NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253231 | 515.93 | C21 H18 Cl N7 O5 S | JWMCTRFQSSAZMN-UHFFFAOYSA-N | InChI=1S/C21H18ClN7O5S/c1-9(19(30)26-13-5-12(22)14(32-3)6-15(13)33-4)35-20-11(8-24)16(10(7-23)18(25)27-20)17-21(31)34-28-29(17)2/h5-6,9H,1-4H3,(H3-,25,26,27,28,30,31) | CC(C(=O)Nc1cc(c(cc1OC)OC)Cl)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005251358 | 461.298 | C21 H18 Cl2 N4 O4 | RRKGOMFCKGFJNA-UHFFFAOYSA-O | InChI=1S/C21H17Cl2N4O4/c1-27-18(21(30)31-26-27)12-17(25-19(28)14-5-3-2-4-6-14)20(29)24-10-9-13-7-8-15(22)11-16(13)23/h2-8,11-12H,9-10H2,1H3,(H,24,29)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCc2ccc(cc2Cl)Cl)\NC(=O)c3ccccc3 | |
| AKOS005253913 | 455.462 | C21 H18 F N5 O4 S | VVJNJFKGUPJTGE-UHFFFAOYSA-N | InChI=1S/C21H18FN5O4S/c1-25-17(20(30)31-24-25)12-26-16(11-18(28)23-14-9-7-13(22)8-10-14)19(29)27(21(26)32)15-5-3-2-4-6-15/h2-10,16H,11-12H2,1H3,(H-,23,24,28,30) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)c3ccccc3)CC(=O)Nc4ccc(cc4)F | |
| AKOS005252888 | 477.46 | C21 H18 F3 N5 O3 S | QQNBFJFFMXCZLS-UHFFFAOYSA-N | InChI=1S/C21H18F3N5O3S/c1-12(2)29-10-19(32-28-29)27-18(30)11-33-20-15(9-25)16(21(22,23)24)8-17(26-20)13-4-6-14(31-3)7-5-13/h4-8,10,12H,11H2,1-3H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccc(cc3)OC)C(F)(F)F)C#N | |
| AKOS005253326 | 493.459 | C21 H18 F3 N5 O4 S | OYEXPDKLNIVWQH-UHFFFAOYSA-N | InChI=1S/C21H18F3N5O4S/c1-31-8-7-29-11-19(33-28-29)27-18(30)12-34-20-15(10-25)16(21(22,23)24)9-17(26-20)13-3-5-14(32-2)6-4-13/h3-6,9,11H,7-8,12H2,1-2H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccc(cc3)OC)C(F)(F)F)C#N | |
| AKOS005253808 | 563.368 | C21 H18 I N5 O4 S | MQNBKVHXOXKJGU-UHFFFAOYSA-N | InChI=1S/C21H18IN5O4S/c1-25-17(20(30)31-24-25)12-26-16(11-18(28)23-14-9-7-13(22)8-10-14)19(29)27(21(26)32)15-5-3-2-4-6-15/h2-10,16H,11-12H2,1H3,(H-,23,24,28,30) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)c3ccccc3)CC(=O)Nc4ccc(cc4)I | |
| AKOS005250734 | 406.458 | C21 H18 N4 O3 S | UEEIKZGIKGSRGI-UHFFFAOYSA-N | InChI=1S/C21H18N4O3S/c1-25-19(21(27)28-24-25)18(26)12-29-20-16(11-22)10-15-9-14(7-8-17(15)23-20)13-5-3-2-4-6-13/h2-6,10,14H,7-9,12H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2c(cc3c(n2)CCC(C3)c4ccccc4)C#N | |
| AKOS005250836 | 406.458 | C21 H18 N4 O3 S | JOYDYYHHFVNBKH-UHFFFAOYSA-N | InChI=1S/C21H18N4O3S/c22-12-15-11-14-7-3-1-6-10-17(14)23-20(15)29-13-18(26)19-21(27)28-24-25(19)16-8-4-2-5-9-16/h2,4-5,8-9,11H,1,3,6-7,10,13H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(cc4c(n3)CCCCC4)C#N | |
| AKOS005250842 | 406.458 | C21 H18 N4 O3 S | PFZFBCCNYFGNTF-UHFFFAOYSA-N | InChI=1S/C21H18N4O3S/c1-13-7-8-17-14(9-13)10-15(11-22)20(23-17)29-12-18(26)19-21(27)28-24-25(19)16-5-3-2-4-6-16/h2-6,10,13H,7-9,12H2,1H3 | CC1CCc2c(cc(c(n2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])C#N)C1 | |
| AKOS005251972 | 406.458 | C21 H18 N4 O3 S | SDRNQBBPTVNITP-UHFFFAOYSA-N | InChI=1S/C21H18N4O3S/c1-2-18(19(26)23-17-12-6-11-16-15(17)10-7-13-22-16)29-20-21(27)28-24-25(20)14-8-4-3-5-9-14/h3-13,18H,2H2,1H3,(H-,22,23,24,26,27) | CCC(C(=O)Nc1cccc2c1cccn2)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005253795 | 406.458 | C21 H18 N4 O3 S | KUBRSDONBIEDBM-UHFFFAOYSA-N | InChI=1S/C21H18N4O3S/c1-11-7-8-15-12(9-11)10-14-16(22)19(29-20(14)23-15)18(26)17-21(27)28-24-25(17)13-5-3-2-4-6-13/h2-6,10-11H,7-9H2,1H3,(H2-,22,24,26,27) | CC1CCc2c(cc3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)C1 | |
| AKOS005253796 | 406.458 | C21 H18 N4 O3 S | YTIRJPULXKHDMX-UHFFFAOYSA-N | InChI=1S/C21H18N4O3S/c22-16-14-11-12-7-3-1-6-10-15(12)23-20(14)29-19(16)18(26)17-21(27)28-24-25(17)13-8-4-2-5-9-13/h2,4-5,8-9,11H,1,3,6-7,10H2,(H2-,22,24,26,27) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4cc5c(nc4s3)CCCCC5)N | |
| AKOS005253898 | 406.458 | C21 H18 N4 O3 S | YXQKGAVVBHDNBX-UHFFFAOYSA-N | InChI=1S/C21H18N4O3S/c1-25-17(21(27)28-24-25)18(26)19-16(22)14-10-13-9-12(11-5-3-2-4-6-11)7-8-15(13)23-20(14)29-19/h2-6,10,12H,7-9H2,1H3,(H2-,22,24,26,27) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3cc4c(nc3s2)CCC(C4)c5ccccc5)N | |
| AKOS005251014 | 390.392 | C21 H18 N4 O4 | NVBZEYNMDNNZRV-UHFFFAOYSA-O | InChI=1S/C21H17N4O4/c26-19(14-7-3-1-4-8-14)23-17(20(27)22-15-11-12-15)13-18-21(28)29-24-25(18)16-9-5-2-6-10-16/h1-10,13,15H,11-12H2,(H,22,27)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NC4CC4 | |
| AKOS005251045 | 390.392 | C21 H18 N4 O4 | HYNCLUKQENRECU-UHFFFAOYSA-O | InChI=1S/C21H17N4O4/c1-2-13-22-20(27)17(23-19(26)15-9-5-3-6-10-15)14-18-21(28)29-24-25(18)16-11-7-4-8-12-16/h2-12,14H,1,13H2,(H,22,27)/q-1/p+1 | C=CCNC(=O)/C(=C/c1c(on[n+]1c2ccccc2)[O-])/NC(=O)c3ccccc3 | |
| AKOS005250461 | 422.457 | C21 H18 N4 O4 S | BEUWXUCKXVDTSQ-UHFFFAOYSA-N | InChI=1S/C21H18N4O4S/c1-28-16-8-6-15(7-9-16)25-19(21(27)29-24-25)18(26)12-30-20-14(11-22)10-13-4-2-3-5-17(13)23-20/h6-10H,2-5,12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(cc4c(n3)CCCC4)C#N | |
| AKOS005251864 | 422.457 | C21 H18 N4 O4 S | SSGDJGYTBNMWCU-UHFFFAOYSA-N | InChI=1S/C21H18N4O4S/c1-13(19(26)23-18-7-3-6-17-16(18)5-4-12-22-17)30-20-21(27)29-24-25(20)14-8-10-15(28-2)11-9-14/h3-13H,1-2H3,(H-,22,23,24,26,27) | CC(C(=O)Nc1cccc2c1cccn2)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252641 | 422.457 | C21 H18 N4 O4 S | OHVHJNAQGXOAGM-UHFFFAOYSA-N | InChI=1S/C21H18N4O4S/c1-28-15-9-7-14(8-10-15)25-20(21(27)29-24-25)30-13-11-19(26)23-18-6-2-5-17-16(18)4-3-12-22-17/h2-10,12H,11,13H2,1H3,(H-,22,23,24,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cccc4c3cccn4 | |
| AKOS005253723 | 422.457 | C21 H18 N4 O4 S | UWERASOAJQYGDP-UHFFFAOYSA-N | InChI=1S/C21H18N4O4S/c1-28-13-8-6-12(7-9-13)25-17(21(27)29-24-25)18(26)19-16(22)14-10-11-4-2-3-5-15(11)23-20(14)30-19/h6-10H,2-5H2,1H3,(H2-,22,24,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4cc5c(nc4s3)CCCC5)N | |
| AKOS005253783 | 422.457 | C21 H18 N4 O4 S | NWPUDYSWJCBYGP-UHFFFAOYSA-N | InChI=1S/C21H18N4O4S/c1-11(2)10-12-4-9-15-16(22)19(30-20(15)23-12)18(26)17-21(27)29-24-25(17)13-5-7-14(28-3)8-6-13/h4-10H,1-3H3,(H2-,22,24,26,27) | CC(=Cc1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N)C | |
| AKOS005253793 | 422.457 | C21 H18 N4 O4 S | MCENHWDAHUMLQH-UHFFFAOYSA-N | InChI=1S/C21H18N4O4S/c1-9-6-5-7-12(8-9)14-13(11(3)26)10(2)23-20-15(14)16(22)19(30-20)18(27)17-21(28)29-24-25(17)4/h5-8H,1-4H3,(H2-,22,24,27,28) | Cc1cccc(c1)c2c3c(c(sc3nc(c2C(=O)C)C)C(=O)c4c(on[n+]4C)[O-])N | |
| AKOS005253283 | 406.391 | C21 H18 N4 O5 | VWTBEUWKDSEPIM-UHFFFAOYSA-N | InChI=1S/C21H18N4O5/c1-13(26)14-7-9-15(10-8-14)24-19(27)11-17(20(24)28)22-12-18-21(29)30-23-25(18)16-5-3-2-4-6-16/h2-10,17,22H,11-12H2,1H3 | CC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)NCc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250433 | 438.456 | C21 H18 N4 O5 S | UTAZCYYFUWQPEO-UHFFFAOYSA-N | InChI=1S/C21H18N4O5S/c1-3-24-19(27)15-6-4-5-7-16(15)22-21(24)31-12-17(26)18-20(28)30-23-25(18)13-8-10-14(29-2)11-9-13/h4-11H,3,12H2,1-2H3 | CCn1c(=O)c2ccccc2nc1SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005250912 | 422.391 | C21 H18 N4 O6 | YXMWOJHFGBDKQK-UHFFFAOYSA-O | InChI=1S/C21H17N4O6/c1-25-16(21(28)31-24-25)10-15(23-19(26)14-5-3-2-4-6-14)20(27)22-11-13-7-8-17-18(9-13)30-12-29-17/h2-10H,11-12H2,1H3,(H,22,27)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCc2ccc3c(c2)OCO3)\NC(=O)c4ccccc4 | |
| AKOS005253284 | 422.391 | C21 H18 N4 O6 | HEASRAVWKWCNIB-UHFFFAOYSA-N | InChI=1S/C21H18N4O6/c1-30-20(28)13-7-9-14(10-8-13)24-18(26)11-16(19(24)27)22-12-17-21(29)31-23-25(17)15-5-3-2-4-6-15/h2-10,16,22H,11-12H2,1H3 | COC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)NCc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250455 | 454.456 | C21 H18 N4 O6 S | XASLCDDJVFPEAR-UHFFFAOYSA-N | InChI=1S/C21H18N4O6S/c1-4-30-20(27)15-9-12(2)23-19(16(15)10-22)32-11-17(26)18-21(28)31-24-25(18)13-5-7-14(29-3)8-6-13/h5-9H,4,11H2,1-3H3 | CCOC(=O)c1cc(nc(c1C#N)SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005254202 | 454.456 | C21 H18 N4 O6 S | YYRKSKOVBZESSR-UHFFFAOYSA-N | InChI=1S/C21H18N4O6S/c1-4-30-20(27)13-9-10(2)23-19-14(13)15(22)18(32-19)17(26)16-21(28)31-24-25(16)11-5-7-12(29-3)8-6-11/h5-9H,4H2,1-3H3,(H2-,22,24,26,28) | CCOC(=O)c1cc(nc2c1c(c(s2)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N)C | |
| AKOS005252480 | 418.472 | C21 H18 N6 O2 S | FNWUOAQLSCODQU-UHFFFAOYSA-N | InChI=1S/C21H18N6O2S/c1-2-27-13-18(29-26-27)22-17(28)14-30-21-23-19(15-9-5-3-6-10-15)20(24-25-21)16-11-7-4-8-12-16/h3-13H,2,14H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2nc(c(nn2)c3ccccc3)c4ccccc4 | |
| AKOS005250690 | 434.471 | C21 H18 N6 O3 S | AXLJITLGOATEDG-UHFFFAOYSA-N | InChI=1S/C21H18N6O3S/c1-11(2)12-4-6-13(7-5-12)17-14(8-22)19(24)25-20(15(17)9-23)31-10-16(28)18-21(29)30-26-27(18)3/h4-7,11H,10H2,1-3H3,(H2-,24,25,26,28,29) | CC(C)c1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)c3c(on[n+]3C)[O-])N)C#N | |
| AKOS005252807 | 434.471 | C21 H18 N6 O3 S | BEQMDWZELYSOIM-SFQUDFHCSA-N | InChI=1S/C21H18N6O3S/c1-2-26-13-19(30-25-26)24-18(28)14-31-21-23-17(12-15-8-6-7-11-22-15)20(29)27(21)16-9-4-3-5-10-16/h3-13H,2,14H2,1H3/b17-12+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccn3)/C(=O)N2c4ccccc4 | |
| AKOS005252808 | 434.471 | C21 H18 N6 O3 S | ZWAQLDVIEZAGHM-GZTJUZNOSA-N | InChI=1S/C21H18N6O3S/c1-2-26-13-19(30-25-26)24-18(28)14-31-21-23-17(11-15-7-6-10-22-12-15)20(29)27(21)16-8-4-3-5-9-16/h3-13H,2,14H2,1H3/b17-11+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccnc3)/C(=O)N2c4ccccc4 | |
| AKOS005252809 | 434.471 | C21 H18 N6 O3 S | UCVAGACGHTWWHG-SFQUDFHCSA-N | InChI=1S/C21H18N6O3S/c1-2-26-13-19(30-25-26)24-18(28)14-31-21-23-17(12-15-8-10-22-11-9-15)20(29)27(21)16-6-4-3-5-7-16/h3-13H,2,14H2,1H3/b17-12+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccncc3)/C(=O)N2c4ccccc4 | |
| AKOS005253885 | 434.471 | C21 H18 N6 O3 S | VUPGXWGVPAJHLU-UHFFFAOYSA-N | InChI=1S/C21H18N6O3S/c1-9(2)10-4-6-11(7-5-10)13-12(8-22)19(24)25-20-14(13)15(23)18(31-20)17(28)16-21(29)30-26-27(16)3/h4-7,9H,1-3H3,(H4-,23,24,25,26,28,29) | CC(C)c1ccc(cc1)c2c(c(nc3c2c(c(s3)C(=O)c4c(on[n+]4C)[O-])N)N)C#N | |
| AKOS005250424 | 450.47 | C21 H18 N6 O4 S | MDFXKAYUVONQQQ-UHFFFAOYSA-N | InChI=1S/C21H18N6O4S/c1-11(2)17-14(8-22)19(24)25-20(15(17)9-23)32-10-16(28)18-21(29)31-26-27(18)12-4-6-13(30-3)7-5-12/h4-7,11H,10H2,1-3H3,(H2-,24,25,26,28,29) | CC(C)c1c(c(nc(c1C#N)SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])N)C#N | |
| AKOS005253748 | 450.47 | C21 H18 N6 O4 S | IWYPYUKDPNLZEY-UHFFFAOYSA-N | InChI=1S/C21H18N6O4S/c1-9(2)13-12(8-22)19(24)25-20-14(13)15(23)18(32-20)17(28)16-21(29)31-26-27(16)10-4-6-11(30-3)7-5-10/h4-7,9H,1-3H3,(H4-,23,24,25,26,28,29) | CC(C)c1c(c(nc2c1c(c(s2)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N)N)C#N | |
| AKOS005250749 | 482.469 | C21 H18 N6 O6 S | DHGLSWCAHWMQIX-UHFFFAOYSA-N | InChI=1S/C21H18N6O6S/c1-27-17(21(29)33-26-27)13(28)9-34-20-12(8-23)16(11(7-22)19(24)25-20)10-5-14(30-2)18(32-4)15(6-10)31-3/h5-6H,9H2,1-4H3,(H2-,24,25,26,28,29) | C[n+]1c(c(on1)[O-])C(=O)CSc2c(c(c(c(n2)N)C#N)c3cc(c(c(c3)OC)OC)OC)C#N | |
| AKOS005253895 | 482.469 | C21 H18 N6 O6 S | KFLRQVLJZLTOSC-UHFFFAOYSA-N | InChI=1S/C21H18N6O6S/c1-27-15(21(29)33-26-27)16(28)18-14(23)13-12(9(7-22)19(24)25-20(13)34-18)8-5-10(30-2)17(32-4)11(6-8)31-3/h5-6H,1-4H3,(H4-,23,24,25,26,28,29) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4cc(c(c(c4)OC)OC)OC)N | |
| AKOS005253925 | 482.469 | C21 H18 N6 O6 S | PJPNWFKSOLRRPN-UHFFFAOYSA-N | InChI=1S/C21H18N6O6S/c1-24-17(20(30)33-23-24)12-25-16(19(29)26(21(25)34)14-5-3-2-4-6-14)11-18(28)22-13-7-9-15(10-8-13)27(31)32/h2-10,16H,11-12H2,1H3,(H-,22,23,28,30) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)c3ccccc3)CC(=O)Nc4ccc(cc4)N(=O)=O | |
| AKOS005252946 | 462.484 | C21 H18 N8 O3 S | MLGSRQAYNQCWHO-UHFFFAOYSA-N | InChI=1S/C21H18N8O3S/c22-10-15-19(14-4-2-1-3-5-14)16(11-23)21(26-20(15)24)33-13-17(30)25-18-12-29(27-32-18)28-6-8-31-9-7-28/h1-5,12H,6-9,13H2,(H2-,24,25,26,27,30) | c1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)N)C#N | |
| AKOS005253187 | 478.484 | C21 H18 N8 O4 S | LQUKOCLSBRFNAN-UHFFFAOYSA-N | InChI=1S/C21H18N8O4S/c1-10(19(31)26-13-6-4-12(5-7-13)25-11(2)30)34-20-15(9-23)16(14(8-22)18(24)27-20)17-21(32)33-28-29(17)3/h4-7,10,28H,1-3H3,(H3,24,27,32) | CC(C(=O)Nc1ccc(cc1)NC(=O)C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005251293 | 487.303 | C21 H19 Br N4 O5 | YCGADABPEFUEBF-UHFFFAOYSA-N | InChI=1S/C21H19BrN4O5/c1-24(17-11-19(27)25(20(17)28)14-5-3-13(22)4-6-14)12-18-21(29)31-23-26(18)15-7-9-16(30-2)10-8-15/h3-10,17H,11-12H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C3CC(=O)N(C3=O)c4ccc(cc4)Br | |
| AKOS005253642 | 487.303 | C21 H19 Br N4 O5 | CPMRMUKECCUUJU-UHFFFAOYSA-N | InChI=1S/C21H19BrN4O5/c22-14-6-8-15(9-7-14)23-19(27)12-18-20(28)25(10-11-30-18)13-17-21(29)31-24-26(17)16-4-2-1-3-5-16/h1-9,18H,10-13H2,(H-,23,24,27,29) | c1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)Br | |
| AKOS005250904 | 426.853 | C21 H19 Cl N4 O4 | UBMCAVRYPMBNQG-UHFFFAOYSA-O | InChI=1S/C21H18ClN4O4/c1-26-18(21(29)30-25-26)13-17(24-19(27)15-8-3-2-4-9-15)20(28)23-12-11-14-7-5-6-10-16(14)22/h2-10,13H,11-12H2,1H3,(H,23,28)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCc2ccccc2Cl)\NC(=O)c3ccccc3 | |
| AKOS005250905 | 426.853 | C21 H19 Cl N4 O4 | YBEUCXCUKUUKOD-UHFFFAOYSA-O | InChI=1S/C21H18ClN4O4/c1-26-18(21(29)30-25-26)13-17(24-19(27)15-5-3-2-4-6-15)20(28)23-12-11-14-7-9-16(22)10-8-14/h2-10,13H,11-12H2,1H3,(H,23,28)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCc2ccc(cc2)Cl)\NC(=O)c3ccccc3 | |
| AKOS005250935 | 426.853 | C21 H19 Cl N4 O4 | KMNLTDQZEXZTGW-UHFFFAOYSA-O | InChI=1S/C21H18ClN4O4/c1-26-18(21(29)30-25-26)13-17(24-19(27)15-7-3-2-4-8-15)20(28)23-11-10-14-6-5-9-16(22)12-14/h2-9,12-13H,10-11H2,1H3,(H,23,28)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCc2cccc(c2)Cl)\NC(=O)c3ccccc3 | |
| AKOS005250098 | 442.852 | C21 H19 Cl N4 O5 | HVLDZOYTTKASSM-UHFFFAOYSA-N | InChI=1S/C21H19ClN4O5/c22-14-6-8-15(9-7-14)23-19(27)12-18-20(28)25(10-11-30-18)13-17-21(29)31-24-26(17)16-4-2-1-3-5-16/h1-9,18H,10-13H2,(H-,23,24,27,29) | c1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)Cl | |
| AKOS005251284 | 442.852 | C21 H19 Cl N4 O5 | XRJVODQROOKRGG-UHFFFAOYSA-N | InChI=1S/C21H19ClN4O5/c1-24(17-11-19(27)25(20(17)28)14-5-3-13(22)4-6-14)12-18-21(29)31-23-26(18)15-7-9-16(30-2)10-8-15/h3-10,17H,11-12H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C3CC(=O)N(C3=O)c4ccc(cc4)Cl | |
| AKOS005253113 | 454.933 | C21 H19 Cl N6 O2 S | USDLWJFJOHSPFQ-UHFFFAOYSA-N | InChI=1S/C21H19ClN6O2S/c22-17-7-4-15(5-8-17)18-9-6-16(12-23)21(24-18)31-14-19(29)25-20-13-28(26-30-20)27-10-2-1-3-11-27/h4-9,13H,1-3,10-11,14H2 | c1cc(ccc1c2ccc(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)C#N)Cl | |
| AKOS005250945 | 410.398 | C21 H19 F N4 O4 | WUQVEVXSWBHCTO-UHFFFAOYSA-O | InChI=1S/C21H18FN4O4/c1-26-18(21(29)30-25-26)13-17(24-19(27)15-5-3-2-4-6-15)20(28)23-12-11-14-7-9-16(22)10-8-14/h2-10,13H,11-12H2,1H3,(H,23,28)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCc2ccc(cc2)F)\NC(=O)c3ccccc3 | |
| AKOS005250946 | 410.398 | C21 H19 F N4 O4 | PHKZWUGBQQTLLK-UHFFFAOYSA-O | InChI=1S/C21H18FN4O4/c1-26-18(21(29)30-25-26)13-17(24-19(27)15-8-3-2-4-9-15)20(28)23-12-11-14-7-5-6-10-16(14)22/h2-10,13H,11-12H2,1H3,(H,23,28)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCc2ccccc2F)\NC(=O)c3ccccc3 | |
| AKOS005219795 | 426.398 | C21 H19 F N4 O5 | GHJISYLUADYZNW-UHFFFAOYSA-N | InChI=1S/C21H19FN4O5/c22-14-6-8-15(9-7-14)23-19(27)12-18-20(28)25(10-11-30-18)13-17-21(29)31-24-26(17)16-4-2-1-3-5-16/h1-9,18H,10-13H2,(H-,23,24,27,29) | c1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)F | |
| AKOS005251292 | 426.398 | C21 H19 F N4 O5 | QGGBIBSNBLGKHP-UHFFFAOYSA-N | InChI=1S/C21H19FN4O5/c1-24(17-11-19(27)25(20(17)28)14-5-3-13(22)4-6-14)12-18-21(29)31-23-26(18)15-7-9-16(30-2)10-8-15/h3-10,17H,11-12H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C3CC(=O)N(C3=O)c4ccc(cc4)F | |
| AKOS005253573 | 534.304 | C21 H19 I N4 O5 | OPFFLNQORQMOMP-UHFFFAOYSA-N | InChI=1S/C21H19IN4O5/c22-14-6-8-15(9-7-14)23-19(27)12-18-20(28)25(10-11-30-18)13-17-21(29)31-24-26(17)16-4-2-1-3-5-16/h1-9,18H,10-13H2,(H-,23,24,27,29) | c1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)I | |
| AKOS005250323 | 361.394 | C21 H19 N3 O3 | ZNCMHVRLBUWYSZ-SDNWHVSQSA-N | InChI=1S/C21H19N3O3/c25-20(14-11-16-7-3-1-4-8-16)23(17-12-13-17)15-19-21(26)27-22-24(19)18-9-5-2-6-10-18/h1-11,14,17H,12-13,15H2/b14-11+ | c1ccc(cc1)/C=C/C(=O)N(Cc2c(on[n+]2c3ccccc3)[O-])C4CC4 | |
| AKOS005215645 | 373.408 | C21 H19 N5 O2 | RKVMPCZVCDEOQP-UHFFFAOYSA-N | InChI=1S/C21H19N5O2/c1-13(2)26-18(17-15-8-9-16(10-15)21(17,11-22)12-23)20(28-25-26)24-19(27)14-6-4-3-5-7-14/h3-9,13,15-17H,10H2,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)C3C4CC(C3(C#N)C#N)C=C4 | |
| AKOS005252471 | 405.473 | C21 H19 N5 O2 S | HHXZIGIFFLVFRG-UHFFFAOYSA-N | InChI=1S/C21H19N5O2S/c1-2-26-13-18(28-25-26)22-17(27)14-29-21-23-19(15-9-5-3-6-10-15)20(24-21)16-11-7-4-8-12-16/h3-13H,2,14H2,1H3,(H-,22,23,24,25,27) | CC[n+]1cc(on1)[N-]C(=O)CSc2[nH]c(c(n2)c3ccccc3)c4ccccc4 | |
| AKOS005252526 | 405.473 | C21 H19 N5 O2 S | FATDWMXOURRNJL-UHFFFAOYSA-N | InChI=1S/C21H19N5O2S/c1-26-12-20(28-25-26)24-19(27)13-29-21-17(11-22)10-16-9-15(7-8-18(16)23-21)14-5-3-2-4-6-14/h2-6,10,12,15H,7-9,13H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCC(C3)c4ccccc4)C#N | |
| AKOS005252883 | 421.472 | C21 H19 N5 O3 S | RVQZYXAYIVGOMB-UHFFFAOYSA-N | InChI=1S/C21H19N5O3S/c1-14(2)25-12-19(29-24-25)23-18(27)13-30-21-22-17-11-7-6-10-16(17)20(28)26(21)15-8-4-3-5-9-15/h3-12,14H,13H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3c(=O)n2c4ccccc4 | |
| AKOS005252775 | 453.537 | C21 H19 N5 O3 S2 | WHENSHBBFWXBGN-GZTJUZNOSA-N | InChI=1S/C21H19N5O3S2/c1-14(2)25-12-19(29-24-25)23-18(27)13-31-21-22-17(11-16-9-6-10-30-16)20(28)26(21)15-7-4-3-5-8-15/h3-12,14H,13H2,1-2H3/b17-11+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccs3)/C(=O)N2c4ccccc4 | |
| AKOS005252781 | 437.472 | C21 H19 N5 O4 S | HECMHKRATZMVHA-GZTJUZNOSA-N | InChI=1S/C21H19N5O4S/c1-14(2)25-12-19(30-24-25)23-18(27)13-31-21-22-17(11-16-9-6-10-29-16)20(28)26(21)15-7-4-3-5-8-15/h3-12,14H,13H2,1-2H3/b17-11+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccco3)/C(=O)N2c4ccccc4 | |
| AKOS005253290 | 437.472 | C21 H19 N5 O4 S | MMWVOMRNGSHUJH-UHFFFAOYSA-N | InChI=1S/C21H19N5O4S/c1-29-12-11-25-13-19(30-24-25)23-18(27)14-31-21-22-17-10-6-5-9-16(17)20(28)26(21)15-7-3-2-4-8-15/h2-10,13H,11-12,14H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2nc3ccccc3c(=O)n2c4ccccc4 | |
| AKOS005253910 | 437.472 | C21 H19 N5 O4 S | PCWOVVSEIXJDLK-UHFFFAOYSA-N | InChI=1S/C21H19N5O4S/c1-24-17(20(29)30-23-24)13-25-16(12-18(27)22-14-8-4-2-5-9-14)19(28)26(21(25)31)15-10-6-3-7-11-15/h2-11,16H,12-13H2,1H3,(H-,22,23,27,29) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)c3ccccc3)CC(=O)Nc4ccccc4 | |
| AKOS005251670 | 469.537 | C21 H19 N5 O4 S2 | POHCPYYYRQPFPZ-UHFFFAOYSA-N | InChI=1S/C21H19N5O4S2/c1-12(31-20-21(29)30-24-26(20)14-6-4-3-5-7-14)18(28)23-19-16(10-22)15-8-9-25(13(2)27)11-17(15)32-19/h3-7,12H,8-9,11H2,1-2H3,(H-,23,24,28,29) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)C)C#N)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252563 | 469.537 | C21 H19 N5 O4 S2 | DJHQDPFHRHTJMJ-UHFFFAOYSA-N | InChI=1S/C21H19N5O4S2/c1-13(27)25-9-7-15-16(11-22)19(32-17(15)12-25)23-18(28)8-10-31-20-21(29)30-24-26(20)14-5-3-2-4-6-14/h2-6H,7-10,12H2,1H3,(H-,23,24,28,29) | CC(=O)N1CCc2c(sc(c2C#N)NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005253321 | 469.537 | C21 H19 N5 O4 S2 | VPEZPZHTSALIHE-SFQUDFHCSA-N | InChI=1S/C21H19N5O4S2/c1-29-10-9-25-13-19(30-24-25)23-18(27)14-32-21-22-17(12-16-8-5-11-31-16)20(28)26(21)15-6-3-2-4-7-15/h2-8,11-13H,9-10,14H2,1H3/b17-12+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccs3)/C(=O)N2c4ccccc4 | |
| AKOS005251277 | 421.406 | C21 H19 N5 O5 | ZUFWVGHQCZOIKD-UHFFFAOYSA-N | InChI=1S/C21H19N5O5/c1-24(12-17-21(30)31-23-26(17)15-5-3-2-4-6-15)16-11-18(27)25(20(16)29)14-9-7-13(8-10-14)19(22)28/h2-10,16H,11-12H2,1H3,(H2-,22,23,28,30) | CN(Cc1c(on[n+]1c2ccccc2)[O-])C3CC(=O)N(C3=O)c4ccc(cc4)C(=O)N | |
| AKOS005253167 | 421.406 | C21 H19 N5 O5 | IRCTUFUWLATUIF-UHFFFAOYSA-N | InChI=1S/C21H19N5O5/c1-13(27)23-14-7-9-15(10-8-14)25-19(28)11-17(20(25)29)22-12-18-21(30)31-24-26(18)16-5-3-2-4-6-16/h2-10,17,22H,11-12H2,1H3,(H-,23,24,27,30) | CC(=O)Nc1ccc(cc1)N2C(=O)CC(C2=O)NCc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005253365 | 453.471 | C21 H19 N5 O5 S | ZCTGUOXEKNIWBE-SFQUDFHCSA-N | InChI=1S/C21H19N5O5S/c1-29-11-9-25-13-19(31-24-25)23-18(27)14-32-21-22-17(12-16-8-5-10-30-16)20(28)26(21)15-6-3-2-4-7-15/h2-8,10,12-13H,9,11,14H2,1H3/b17-12+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccco3)/C(=O)N2c4ccccc4 | |
| AKOS005251527 | 485.536 | C21 H19 N5 O5 S2 | VAUYTZPMVRVBJV-UHFFFAOYSA-N | InChI=1S/C21H19N5O5S2/c1-12(27)25-8-7-15-16(9-22)19(33-17(15)10-25)23-18(28)11-32-20-21(29)31-24-26(20)13-3-5-14(30-2)6-4-13/h3-6H,7-8,10-11H2,1-2H3,(H-,23,24,28,29) | CC(=O)N1CCc2c(sc(c2C#N)NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005253172 | 437.405 | C21 H19 N5 O6 | KKTKZCKOYZQNQV-UHFFFAOYSA-N | InChI=1S/C21H19N5O6/c1-31-15-8-6-14(7-9-15)26-17(21(30)32-24-26)11-23-16-10-18(27)25(20(16)29)13-4-2-12(3-5-13)19(22)28/h2-9,16,23H,10-11H2,1H3,(H2-,22,24,28,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)C(=O)N | |
| AKOS005251336 | 453.405 | C21 H19 N5 O7 | VQOAAULMSGGMGG-UHFFFAOYSA-N | InChI=1S/C21H19N5O7/c1-23(12-18-21(29)33-22-25(18)14-7-9-16(32-2)10-8-14)17-11-19(27)24(20(17)28)13-3-5-15(6-4-13)26(30)31/h3-10,17H,11-12H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C3CC(=O)N(C3=O)c4ccc(cc4)[N+](=O)[O-] | |
| AKOS005253604 | 453.405 | C21 H19 N5 O7 | PQEJVDLLTZZZIQ-UHFFFAOYSA-N | InChI=1S/C21H19N5O7/c27-19(22-14-6-8-16(9-7-14)26(30)31)12-18-20(28)24(10-11-32-18)13-17-21(29)33-23-25(17)15-4-2-1-3-5-15/h1-9,18H,10-13H2,(H-,22,23,27,29) | c1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)N(=O)=O | |
| AKOS005252412 | 433.486 | C21 H19 N7 O2 S | SCOJUXZKIAJWME-UHFFFAOYSA-N | InChI=1S/C21H19N7O2S/c1-12(2)13-4-6-14(7-5-13)19-15(8-22)20(24)26-21(16(19)9-23)31-11-17(29)25-18-10-28(3)27-30-18/h4-7,10,12H,11H2,1-3H3,(H2-,24,25,26,27,29) | CC(C)c1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)C)N)C#N | |
| AKOS005252692 | 433.486 | C21 H19 N7 O2 S | KDUIQJHMLFRSLF-UHFFFAOYSA-N | InChI=1S/C21H19N7O2S/c1-27(2)28-13-18(30-26-28)22-17(29)14-31-21-23-19(15-9-5-3-6-10-15)20(24-25-21)16-11-7-4-8-12-16/h3-13H,14H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2nc(c(nn2)c3ccccc3)c4ccccc4 | |
| AKOS005252853 | 433.486 | C21 H19 N7 O2 S | XWKVUCDBMKFZPG-UHFFFAOYSA-N | InChI=1S/C21H19N7O2S/c1-12(2)28-10-18(30-27-28)25-17(29)11-31-21-16(9-23)19(15(8-22)20(24)26-21)14-6-4-13(3)5-7-14/h4-7,10,12H,11H2,1-3H3,(H2-,24,25,26,27,29) | Cc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)C(C)C)N)C#N | |
| AKOS005252931 | 433.486 | C21 H19 N7 O2 S | CJNNNQAWNZRWFM-UHFFFAOYSA-N | InChI=1S/C21H19N7O2S/c1-3-13-5-7-14(8-6-13)19-15(9-22)20(24)26-21(16(19)10-23)31-12-17(29)25-18-11-28(4-2)27-30-18/h5-8,11H,3-4,12H2,1-2H3,(H2-,24,25,26,27,29) | CCc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)CC)N)C#N | |
| AKOS005252743 | 449.486 | C21 H19 N7 O3 S | HXGGQDJRKHWTLC-SFQUDFHCSA-N | InChI=1S/C21H19N7O3S/c1-26(2)27-13-19(31-25-27)24-18(29)14-32-21-23-17(12-15-8-6-7-11-22-15)20(30)28(21)16-9-4-3-5-10-16/h3-13H,14H2,1-2H3/b17-12+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccn3)/C(=O)N2c4ccccc4 | |
| AKOS005252765 | 449.486 | C21 H19 N7 O3 S | BLZUIBOROONWOF-GZTJUZNOSA-N | InChI=1S/C21H19N7O3S/c1-26(2)27-13-19(31-25-27)24-18(29)14-32-21-23-17(11-15-7-6-10-22-12-15)20(30)28(21)16-8-4-3-5-9-16/h3-13H,14H2,1-2H3/b17-11+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccnc3)/C(=O)N2c4ccccc4 | |
| AKOS005252766 | 449.486 | C21 H19 N7 O3 S | CGYRQLLKYIYEBB-SFQUDFHCSA-N | InChI=1S/C21H19N7O3S/c1-26(2)27-13-19(31-25-27)24-18(29)14-32-21-23-17(12-15-8-10-22-11-9-15)20(30)28(21)16-6-4-3-5-7-16/h3-13H,14H2,1-2H3/b17-12+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccncc3)/C(=O)N2c4ccccc4 | |
| AKOS005253191 | 449.486 | C21 H19 N7 O3 S | SPINUCMQQYHKKF-UHFFFAOYSA-N | InChI=1S/C21H19N7O3S/c1-10-5-11(2)7-13(6-10)25-19(29)12(3)32-20-15(9-23)16(14(8-22)18(24)26-20)17-21(30)31-27-28(17)4/h5-7,12H,1-4H3,(H3-,24,25,26,27,29,30) | Cc1cc(cc(c1)NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N)C | |
| AKOS005253252 | 449.486 | C21 H19 N7 O3 S | LWWVBMUCBRZMAO-UHFFFAOYSA-N | InChI=1S/C21H19N7O3S/c1-10-6-5-7-15(11(10)2)25-19(29)12(3)32-20-14(9-23)16(13(8-22)18(24)26-20)17-21(30)31-27-28(17)4/h5-7,12H,1-4H3,(H3-,24,25,26,27,29,30) | Cc1cccc(c1C)NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253253 | 449.486 | C21 H19 N7 O3 S | MFOZOLGRFRCAFG-UHFFFAOYSA-N | InChI=1S/C21H19N7O3S/c1-10-5-6-15(11(2)7-10)25-19(29)12(3)32-20-14(9-23)16(13(8-22)18(24)26-20)17-21(30)31-27-28(17)4/h5-7,12H,1-4H3,(H3-,24,25,26,27,29,30) | Cc1ccc(c(c1)C)NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253255 | 449.486 | C21 H19 N7 O3 S | QLSYNLXMQMKXRV-UHFFFAOYSA-N | InChI=1S/C21H19N7O3S/c1-10-6-5-7-11(2)16(10)25-19(29)12(3)32-20-14(9-23)15(13(8-22)18(24)26-20)17-21(30)31-27-28(17)4/h5-7,12H,1-4H3,(H3-,24,25,26,27,29,30) | Cc1cccc(c1NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N)C | |
| AKOS005253260 | 449.486 | C21 H19 N7 O3 S | FRFHOIRBJHWMJZ-UHFFFAOYSA-N | InChI=1S/C21H19N7O3S/c1-10-5-6-11(2)15(7-10)25-19(29)12(3)32-20-14(9-23)16(13(8-22)18(24)26-20)17-21(30)31-27-28(17)4/h5-7,12H,1-4H3,(H3-,24,25,26,27,29,30) | Cc1ccc(c(c1)NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N)C | |
| AKOS005253261 | 449.486 | C21 H19 N7 O3 S | MOYOMKZLRVDWLY-UHFFFAOYSA-N | InChI=1S/C21H19N7O3S/c1-10-5-6-13(7-11(10)2)25-19(29)12(3)32-20-15(9-23)16(14(8-22)18(24)26-20)17-21(30)31-27-28(17)4/h5-7,12H,1-4H3,(H3-,24,25,26,27,29,30) | Cc1ccc(cc1C)NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253307 | 449.486 | C21 H19 N7 O3 S | LRFNUOFTAVQKQR-UHFFFAOYSA-N | InChI=1S/C21H19N7O3S/c1-13-3-5-14(6-4-13)19-15(9-22)20(24)26-21(16(19)10-23)32-12-17(29)25-18-11-28(27-31-18)7-8-30-2/h3-6,11H,7-8,12H2,1-2H3,(H2-,24,25,26,27,29) | Cc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)CCOC)N)C#N | |
| AKOS005253431 | 449.486 | C21 H19 N7 O3 S | INTPLMWAOWWKRE-UHFFFAOYSA-N | InChI=1S/C21H19N7O3S/c1-4-10-7-5-6-9(2)15(10)25-19(29)17-14(23)13-12(16-21(30)31-27-28(16)3)11(8-22)18(24)26-20(13)32-17/h5-7H,4H2,1-3H3,(H5-,23,24,25,26,27,29,30) | CCc1cccc(c1NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N)C | |
| AKOS005253536 | 449.486 | C21 H19 N7 O3 S | VKSMMZJEYHWAHD-UHFFFAOYSA-N | InChI=1S/C21H19N7O3S/c1-9(2)10-4-6-11(7-5-10)25-19(29)17-15(23)14-13(16-21(30)31-27-28(16)3)12(8-22)18(24)26-20(14)32-17/h4-7,9H,1-3H3,(H5-,23,24,25,26,27,29,30) | CC(C)c1ccc(cc1)NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N | |
| AKOS005253561 | 449.486 | C21 H19 N7 O3 S | OJSITWXAYZDXOR-UHFFFAOYSA-N | InChI=1S/C21H19N7O3S/c1-4-12-7-5-6-11(2)17(12)25-15(29)10-32-20-14(9-23)16(13(8-22)19(24)26-20)18-21(30)31-27-28(18)3/h5-7H,4,10H2,1-3H3,(H3-,24,25,26,27,29,30) | CCc1cccc(c1NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N)C | |
| AKOS005253660 | 449.486 | C21 H19 N7 O3 S | ZZPWHTQTSJIDQI-UHFFFAOYSA-N | InChI=1S/C21H19N7O3S/c1-11(2)12-4-6-13(7-5-12)25-16(29)10-32-20-15(9-23)17(14(8-22)19(24)26-20)18-21(30)31-27-28(18)3/h4-7,11H,10H2,1-3H3,(H3-,24,25,26,27,29,30) | CC(C)c1ccc(cc1)NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253224 | 465.485 | C21 H19 N7 O4 S | NZJHOUDCFVQQJU-UHFFFAOYSA-N | InChI=1S/C21H19N7O4S/c1-4-31-15-8-6-5-7-14(15)25-19(29)11(2)33-20-13(10-23)16(12(9-22)18(24)26-20)17-21(30)32-27-28(17)3/h5-8,11H,4H2,1-3H3,(H3-,24,25,26,27,29,30) | CCOc1ccccc1NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253225 | 465.485 | C21 H19 N7 O4 S | RKXWZKPSMMXTMY-UHFFFAOYSA-N | InChI=1S/C21H19N7O4S/c1-4-31-13-7-5-12(6-8-13)25-19(29)11(2)33-20-15(10-23)16(14(9-22)18(24)26-20)17-21(30)32-27-28(17)3/h5-8,11H,4H2,1-3H3,(H3-,24,25,26,27,29,30) | CCOc1ccc(cc1)NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005252530 | 481.484 | C21 H19 N7 O5 S | YOVDYSFWTAJPNM-UHFFFAOYSA-N | InChI=1S/C21H19N7O5S/c1-28-9-17(33-27-28)25-16(29)10-34-21-13(8-23)18(12(7-22)20(24)26-21)11-5-14(30-2)19(32-4)15(6-11)31-3/h5-6,9H,10H2,1-4H3,(H2-,24,25,26,27,29) | C[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3cc(c(c(c3)OC)OC)OC)C#N | |
| AKOS005253246 | 481.484 | C21 H19 N7 O5 S | SKDJYSWTVHDZFW-UHFFFAOYSA-N | InChI=1S/C21H19N7O5S/c1-10(19(29)25-14-6-5-11(31-3)7-15(14)32-4)34-20-13(9-23)16(12(8-22)18(24)26-20)17-21(30)33-27-28(17)2/h5-7,10H,1-4H3,(H3-,24,25,26,27,29,30) | CC(C(=O)Nc1ccc(cc1OC)OC)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253247 | 481.484 | C21 H19 N7 O5 S | GPEKXOVLOBSPPP-UHFFFAOYSA-N | InChI=1S/C21H19N7O5S/c1-10(19(29)25-14-7-11(31-3)5-6-15(14)32-4)34-20-13(9-23)16(12(8-22)18(24)26-20)17-21(30)33-27-28(17)2/h5-7,10H,1-4H3,(H3-,24,25,26,27,29,30) | CC(C(=O)Nc1cc(ccc1OC)OC)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253254 | 481.484 | C21 H19 N7 O5 S | PLKXRZQDVWANAL-UHFFFAOYSA-N | InChI=1S/C21H19N7O5S/c1-10(19(29)25-11-5-12(31-3)7-13(6-11)32-4)34-20-15(9-23)16(14(8-22)18(24)26-20)17-21(30)33-27-28(17)2/h5-7,10H,1-4H3,(H3-,24,25,26,27,29,30) | CC(C(=O)Nc1cc(cc(c1)OC)OC)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005250296 | 413.854 | C21 H20 Cl N3 O4 | CLOZDYBQQVXJAW-UHFFFAOYSA-N | InChI=1S/C21H20ClN3O4/c1-28-18-10-8-17(9-11-18)25-19(21(27)29-23-25)13-24(16-6-7-16)20(26)12-14-2-4-15(22)5-3-14/h2-5,8-11,16H,6-7,12-13H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)Cc4ccc(cc4)Cl | |
| AKOS005215588 | 419.397 | C21 H20 F3 N3 O3 | VNTUUMMIOYMRRN-UHFFFAOYSA-N | InChI=1S/C21H20F3N3O3/c1-13(2)27-18(19(29)15-8-10-16(11-9-15)21(22,23)24)20(30-26-27)25-17(28)12-14-6-4-3-5-7-14/h3-11,13,19,29H,12H2,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)Cc2ccccc2)C(c3ccc(cc3)C(F)(F)F)O | |
| AKOS005219487 | 451.462 | C21 H20 F3 N3 O3 S | KFZNKXIXWWMTTK-UHFFFAOYSA-N | InChI=1S/C21H20F3N3O3S/c1-13(2)27-18(19(29)14-8-10-15(11-9-14)21(22,23)24)20(30-26-27)25-17(28)12-31-16-6-4-3-5-7-16/h3-11,13,19,29H,12H2,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)CSc2ccccc2)C(c3ccc(cc3)C(F)(F)F)O | |
| AKOS005250488 | 376.408 | C21 H20 N4 O3 | RFTIASXGBSZZMA-VAWYXSNFSA-N | InChI=1S/C21H20N4O3/c26-20(19-21(27)28-22-25(19)18-9-5-2-6-10-18)24-15-13-23(14-16-24)12-11-17-7-3-1-4-8-17/h1-12H,13-16H2/b12-11+ | c1ccc(cc1)/C=C/N2CCN(CC2)C(=O)c3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251755 | 440.538 | C21 H20 N4 O3 S2 | FDRFIFAEZRSMPW-UHFFFAOYSA-N | InChI=1S/C21H20N4O3S2/c1-12-8-9-15-16(11-22)19(30-17(15)10-12)23-18(26)13(2)29-20-21(27)28-24-25(20)14-6-4-3-5-7-14/h3-7,12-13H,8-10H2,1-2H3,(H-,23,24,26,27) | CC1CCc2c(sc(c2C#N)NC(=O)C(C)Sc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005251856 | 440.538 | C21 H20 N4 O3 S2 | WBAFSOSRBQNJKD-UHFFFAOYSA-N | InChI=1S/C21H20N4O3S2/c1-12(29-20-21(27)28-24-25(20)2)18(26)23-19-16(11-22)15-9-8-14(10-17(15)30-19)13-6-4-3-5-7-13/h3-7,12,14H,8-10H2,1-2H3,(H-,23,24,26,27) | CC(C(=O)Nc1c(c2c(s1)CC(CC2)c3ccccc3)C#N)Sc4c(on[n+]4C)[O-] | |
| AKOS005251969 | 440.538 | C21 H20 N4 O3 S2 | QBPCQLSSVWVSBQ-UHFFFAOYSA-N | InChI=1S/C21H20N4O3S2/c1-2-16(30-20-21(27)28-24-25(20)13-8-4-3-5-9-13)18(26)23-19-15(12-22)14-10-6-7-11-17(14)29-19/h3-5,8-9,16H,2,6-7,10-11H2,1H3,(H-,23,24,26,27) | CCC(C(=O)Nc1c(c2c(s1)CCCC2)C#N)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252545 | 440.538 | C21 H20 N4 O3 S2 | SUDARFUYKCSTPA-UHFFFAOYSA-N | InChI=1S/C21H20N4O3S2/c1-13-7-8-15-16(12-22)19(30-17(15)11-13)23-18(26)9-10-29-20-21(27)28-24-25(20)14-5-3-2-4-6-14/h2-6,13H,7-11H2,1H3,(H-,23,24,26,27) | CC1CCc2c(sc(c2C#N)NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005252665 | 440.538 | C21 H20 N4 O3 S2 | JBHSXAMHHXUNEX-UHFFFAOYSA-N | InChI=1S/C21H20N4O3S2/c1-25-20(21(27)28-24-25)29-10-9-18(26)23-19-16(12-22)15-8-7-14(11-17(15)30-19)13-5-3-2-4-6-13/h2-6,14H,7-11H2,1H3,(H-,23,24,26,27) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2c(c3c(s2)CC(CC3)c4ccccc4)C#N | |
| AKOS005250386 | 392.408 | C21 H20 N4 O4 | OYQZTQXCLLNUPO-UHFFFAOYSA-N | InChI=1S/C21H20N4O4/c1-15(26)16-7-9-17(10-8-16)23-11-13-24(14-12-23)20(27)19-21(28)29-22-25(19)18-5-3-2-4-6-18/h2-10H,11-14H2,1H3 | CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)c3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250888 | 392.408 | C21 H20 N4 O4 | NIVVJNAQPZHFFG-UHFFFAOYSA-O | InChI=1S/C21H19N4O4/c1-14-8-10-15(11-9-14)13-22-20(27)17(12-18-21(28)29-24-25(18)2)23-19(26)16-6-4-3-5-7-16/h3-12H,13H2,1-2H3,(H,22,27)/q-1/p+1 | Cc1ccc(cc1)CNC(=O)/C(=C/c2c(on[n+]2C)[O-])/NC(=O)c3ccccc3 | |
| AKOS005250889 | 392.408 | C21 H20 N4 O4 | SWBJGGSXPJAXJA-UHFFFAOYSA-O | InChI=1S/C21H19N4O4/c1-25-18(21(28)29-24-25)14-17(23-19(26)16-10-6-3-7-11-16)20(27)22-13-12-15-8-4-2-5-9-15/h2-11,14H,12-13H2,1H3,(H,22,27)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCc2ccccc2)\NC(=O)c3ccccc3 | |
| AKOS005250960 | 392.408 | C21 H20 N4 O4 | PEOLABQMAVKECD-UHFFFAOYSA-O | InChI=1S/C21H19N4O4/c1-14(15-9-5-3-6-10-15)22-20(27)17(13-18-21(28)29-24-25(18)2)23-19(26)16-11-7-4-8-12-16/h3-14H,1-2H3,(H,22,27)/q-1/p+1 | CC(c1ccccc1)NC(=O)/C(=C/c2c(on[n+]2C)[O-])/NC(=O)c3ccccc3 | |
| AKOS005251346 | 392.408 | C21 H20 N4 O4 | OLHHFLSXUAJFDD-UHFFFAOYSA-N | InChI=1S/C21H20N4O4/c1-14-8-10-15(11-9-14)24-19(26)12-17(20(24)27)23(2)13-18-21(28)29-22-25(18)16-6-4-3-5-7-16/h3-11,17H,12-13H2,1-2H3 | Cc1ccc(cc1)N2C(=O)CC(C2=O)N(C)Cc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250457 | 424.473 | C21 H20 N4 O4 S | HBETXPBBZGBKGR-UHFFFAOYSA-N | InChI=1S/C21H20N4O4S/c1-13(2)10-15-5-4-14(11-22)20(23-15)30-12-18(26)19-21(27)29-24-25(19)16-6-8-17(28-3)9-7-16/h4-9,13H,10,12H2,1-3H3 | CC(C)Cc1ccc(c(n1)SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C#N | |
| AKOS005250463 | 424.473 | C21 H20 N4 O4 S | PXNAGGMCYAROFB-UHFFFAOYSA-N | InChI=1S/C21H20N4O4S/c1-3-4-5-15-7-6-14(12-22)20(23-15)30-13-18(26)19-21(27)29-24-25(19)16-8-10-17(28-2)11-9-16/h6-11H,3-5,13H2,1-2H3 | CCCCc1ccc(c(n1)SCC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C#N | |
| AKOS005251987 | 424.473 | C21 H20 N4 O4 S | LPCNPOOGZFJDTJ-UHFFFAOYSA-N | InChI=1S/C21H20N4O4S/c1-3-18(19(26)23-14-4-9-17-13(12-14)10-11-22-17)30-20-21(27)29-24-25(20)15-5-7-16(28-2)8-6-15/h4-12,18,24,27H,3H2,1-2H3 | CCC(C(=O)Nc1ccc2c(c1)cc[nH]2)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005253715 | 424.473 | C21 H20 N4 O4 S | UNEGJYPYDVGHJW-UHFFFAOYSA-N | InChI=1S/C21H20N4O4S/c1-3-4-5-12-6-11-15-16(22)19(30-20(15)23-12)18(26)17-21(27)29-24-25(17)13-7-9-14(28-2)10-8-13/h6-11H,3-5H2,1-2H3,(H2-,22,24,26,27) | CCCCc1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N | |
| AKOS005253720 | 424.473 | C21 H20 N4 O4 S | RBHABWKZBMPJOT-UHFFFAOYSA-N | InChI=1S/C21H20N4O4S/c1-11(2)10-12-4-9-15-16(22)19(30-20(15)23-12)18(26)17-21(27)29-24-25(17)13-5-7-14(28-3)8-6-13/h4-9,11H,10H2,1-3H3,(H2-,22,24,26,27) | CC(C)Cc1ccc2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N | |
| AKOS005254089 | 424.473 | C21 H20 N4 O4 S | SHZRHAMGMPLTGO-UHFFFAOYSA-N | InChI=1S/C21H20N4O4S/c1-5-14-10(2)15-16(22)19(30-20(15)23-11(14)3)18(26)17-21(27)29-24-25(17)12-6-8-13(28-4)9-7-12/h6-9H,5H2,1-4H3,(H2-,22,24,26,27) | CCc1c(c2c(c(sc2nc1C)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N)C | |
| AKOS005251509 | 456.538 | C21 H20 N4 O4 S2 | ZPQABFAMSKAVLV-UHFFFAOYSA-N | InChI=1S/C21H20N4O4S2/c1-12-3-8-15-16(10-22)19(31-17(15)9-12)23-18(26)11-30-20-21(27)29-24-25(20)13-4-6-14(28-2)7-5-13/h4-7,12H,3,8-9,11H2,1-2H3,(H-,23,24,26,27) | CC1CCc2c(sc(c2C#N)NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005251690 | 456.538 | C21 H20 N4 O4 S2 | AKCIEEPQPKDHRI-UHFFFAOYSA-N | InChI=1S/C21H20N4O4S2/c1-12(18(26)23-19-16(11-22)15-5-3-4-6-17(15)31-19)30-20-21(27)29-24-25(20)13-7-9-14(28-2)10-8-13/h7-10,12H,3-6H2,1-2H3,(H-,23,24,26,27) | CC(C(=O)Nc1c(c2c(s1)CCCC2)C#N)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252605 | 456.538 | C21 H20 N4 O4 S2 | LMXNMOMMAGPJHC-UHFFFAOYSA-N | InChI=1S/C21H20N4O4S2/c1-28-14-8-6-13(7-9-14)25-20(21(27)29-24-25)30-11-10-18(26)23-19-16(12-22)15-4-2-3-5-17(15)31-19/h6-9H,2-5,10-11H2,1H3,(H-,23,24,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3c(c4c(s3)CCCC4)C#N | |
| AKOS005250097 | 408.407 | C21 H20 N4 O5 | ZEUOPZYCRDGOCG-UHFFFAOYSA-N | InChI=1S/C21H20N4O5/c26-19(22-15-7-3-1-4-8-15)13-18-20(27)24(11-12-29-18)14-17-21(28)30-23-25(17)16-9-5-2-6-10-16/h1-10,18H,11-14H2,(H-,22,23,26,28) | c1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250108 | 408.407 | C21 H20 N4 O5 | OGGUWLJOYQCAOQ-UHFFFAOYSA-N | InChI=1S/C21H20N4O5/c1-21(2)8-14(26)17-15(9-21)29-19(23)13(10-22)16(17)18-20(27)30-24-25(18)11-4-6-12(28-3)7-5-11/h4-7,16H,8-9,23H2,1-3H3 | CC1(CC2=C(C(C(=C(O2)N)C#N)c3c(on[n+]3c4ccc(cc4)OC)[O-])C(=O)C1)C | |
| AKOS005250611 | 408.407 | C21 H20 N4 O5 | KRWCAJYPBRFEOD-UHFFFAOYSA-N | InChI=1S/C21H20N4O5/c1-29-16-7-5-15(6-8-16)25-19(21(28)30-22-25)20(27)23-10-13-9-14(12-23)17-3-2-4-18(26)24(17)11-13/h2-8,13-14H,9-12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CC4CC(C3)c5cccc(=O)n5C4 | |
| AKOS005251261 | 408.407 | C21 H20 N4 O5 | IUIVSDADDVEPKM-UHFFFAOYSA-N | InChI=1S/C21H20N4O5/c1-23(13-18-21(28)30-22-25(18)15-6-4-3-5-7-15)17-12-19(26)24(20(17)27)14-8-10-16(29-2)11-9-14/h3-11,17H,12-13H2,1-2H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C3CC(=O)N(C3=O)c4ccc(cc4)OC | |
| AKOS005251276 | 408.407 | C21 H20 N4 O5 | JCGKJJFCGUTOFZ-UHFFFAOYSA-N | InChI=1S/C21H20N4O5/c1-23(17-12-19(26)24(20(17)27)14-6-4-3-5-7-14)13-18-21(28)30-22-25(18)15-8-10-16(29-2)11-9-15/h3-11,17H,12-13H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C3CC(=O)N(C3=O)c4ccccc4 | |
| AKOS005253267 | 408.407 | C21 H20 N4 O5 | YGBUYPBZAKETLW-UHFFFAOYSA-N | InChI=1S/C21H20N4O5/c1-2-29-16-10-8-14(9-11-16)24-19(26)12-17(20(24)27)22-13-18-21(28)30-23-25(18)15-6-4-3-5-7-15/h3-11,17,22H,2,12-13H2,1H3 | CCOc1ccc(cc1)N2C(=O)CC(C2=O)NCc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005253271 | 408.407 | C21 H20 N4 O5 | OHPKFKBSPSDKDS-UHFFFAOYSA-N | InChI=1S/C21H20N4O5/c1-13-3-5-14(6-4-13)24-19(26)11-17(20(24)27)22-12-18-21(28)30-23-25(18)15-7-9-16(29-2)10-8-15/h3-10,17,22H,11-12H2,1-2H3 | Cc1ccc(cc1)N2C(=O)CC(C2=O)NCc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005251011 | 424.407 | C21 H20 N4 O6 | MBLZYHHOYZZMDW-UHFFFAOYSA-O | InChI=1S/C21H19N4O6/c1-30-16-9-7-15(8-10-16)25-18(21(29)31-24-25)13-17(20(28)22-11-12-26)23-19(27)14-5-3-2-4-6-14/h2-10,13,26H,11-12H2,1H3,(H,22,28)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCCO)\NC(=O)c3ccccc3 | |
| AKOS005253279 | 424.407 | C21 H20 N4 O6 | WNENSTJKZCCVIB-UHFFFAOYSA-N | InChI=1S/C21H20N4O6/c1-29-15-7-3-13(4-8-15)24-19(26)11-17(20(24)27)22-12-18-21(28)31-23-25(18)14-5-9-16(30-2)10-6-14/h3-10,17,22H,11-12H2,1-2H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)OC | |
| AKOS005251588 | 488.537 | C21 H20 N4 O6 S2 | AOQOUQZYRNTGJF-UHFFFAOYSA-N | InChI=1S/C21H20N4O6S2/c1-12(26)24-9-8-14-15(10-24)33-18(17(14)20(28)30-2)22-16(27)11-32-19-21(29)31-23-25(19)13-6-4-3-5-7-13/h3-7H,8-11H2,1-2H3,(H-,22,23,27,28,29) | CC(=O)N1CCc2c(sc(c2C(=O)OC)NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005250195 | 472.471 | C21 H20 N4 O7 S | DBSRLSHGMINBFW-UHFFFAOYSA-N | InChI=1S/C21H20N4O7S/c1-11(26)24-9-8-14-15(10-24)33-19(16(14)20(28)31-3)22-18(27)17-21(29)32-23-25(17)12-4-6-13(30-2)7-5-12/h4-7H,8-10H2,1-3H3,(H-,22,23,27,28,29) | CC(=O)N1CCc2c(sc(c2C(=O)OC)NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005252690 | 420.488 | C21 H20 N6 O2 S | COKZYRFOCGESBV-UHFFFAOYSA-N | InChI=1S/C21H20N6O2S/c1-26(2)27-13-18(29-25-27)22-17(28)14-30-21-23-19(15-9-5-3-6-10-15)20(24-21)16-11-7-4-8-12-16/h3-13H,14H2,1-2H3,(H-,22,23,24,25,28) | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2[nH]c(c(n2)c3ccccc3)c4ccccc4 | |
| AKOS005253062 | 420.488 | C21 H20 N6 O2 S | KEYWKWSAZQJYBK-UHFFFAOYSA-N | InChI=1S/C21H20N6O2S/c22-13-17-9-10-18(16-7-3-1-4-8-16)23-21(17)30-15-19(28)24-20-14-27(25-29-20)26-11-5-2-6-12-26/h1,3-4,7-10,14H,2,5-6,11-12,15H2 | c1ccc(cc1)c2ccc(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)C#N | |
| AKOS005252998 | 436.487 | C21 H20 N6 O3 S | CRGPMDIIRWWIAV-UHFFFAOYSA-N | InChI=1S/C21H20N6O3S/c1-15-2-4-16(5-3-15)18-7-6-17(12-22)21(23-18)31-14-19(28)24-20-13-27(25-30-20)26-8-10-29-11-9-26/h2-7,13H,8-11,14H2,1H3 | Cc1ccc(cc1)c2ccc(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)C#N | |
| AKOS005251314 | 420.421 | C21 H20 N6 O4 | DSNKSHAXMOXJIK-GHVJWSGMSA-N | InChI=1S/C21H20N6O4/c1-25(13-18-21(30)31-24-26(18)2)17-12-19(28)27(20(17)29)16-10-8-15(9-11-16)23-22-14-6-4-3-5-7-14/h3-11,17H,12-13H2,1-2H3/b23-22+ | C[n+]1c(c(on1)[O-])CN(C)C2CC(=O)N(C2=O)c3ccc(cc3)/N=N/c4ccccc4 | |
| AKOS005252993 | 452.486 | C21 H20 N6 O4 S | IABGRXDMIWOGTR-UHFFFAOYSA-N | InChI=1S/C21H20N6O4S/c1-29-17-5-2-15(3-6-17)18-7-4-16(12-22)21(23-18)32-14-19(28)24-20-13-27(25-31-20)26-8-10-30-11-9-26/h2-7,13H,8-11,14H2,1H3 | COc1ccc(cc1)c2ccc(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)C#N | |
| AKOS005253914 | 516.55 | C21 H20 N6 O6 S2 | KCBPOXCSDVGAOX-UHFFFAOYSA-N | InChI=1S/C21H20N6O6S2/c1-25-17(20(30)33-24-25)12-26-16(19(29)27(21(26)34)14-5-3-2-4-6-14)11-18(28)23-13-7-9-15(10-8-13)35(22,31)32/h2-10,16H,11-12H2,1H3,(H3-,22,23,24,28,30,31,32) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)c3ccccc3)CC(=O)Nc4ccc(cc4)S(=O)(=O)N | |
| AKOS005252747 | 448.501 | C21 H20 N8 O2 S | XMXUXFYOKNEQJM-UHFFFAOYSA-N | InChI=1S/C21H20N8O2S/c1-4-13-5-7-14(8-6-13)19-15(9-22)20(24)26-21(16(19)10-23)32-12-17(30)25-18-11-29(27-31-18)28(2)3/h5-8,11H,4,12H2,1-3H3,(H2-,24,25,26,27,30) | CCc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N(C)C)N)C#N | |
| AKOS005250390 | 363.41 | C21 H21 N3 O3 | OXDODKOFNAJIOT-UHFFFAOYSA-N | InChI=1S/C21H21N3O3/c25-20(19-21(26)27-22-24(19)18-9-5-2-6-10-18)23-13-11-17(12-14-23)15-16-7-3-1-4-8-16/h1-10,17H,11-15H2 | c1ccc(cc1)CC2CCN(CC2)C(=O)c3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250282 | 379.409 | C21 H21 N3 O4 | OXJNWZCSRYGNQX-UHFFFAOYSA-N | InChI=1S/C21H21N3O4/c1-14-5-3-4-6-18(14)20(25)23(15-7-8-15)13-19-21(26)28-22-24(19)16-9-11-17(27-2)12-10-16/h3-6,9-12,15H,7-8,13H2,1-2H3 | Cc1ccccc1C(=O)N(Cc2c(on[n+]2c3ccc(cc3)OC)[O-])C4CC4 | |
| AKOS005250283 | 379.409 | C21 H21 N3 O4 | IDEOQAFDIDPJCE-UHFFFAOYSA-N | InChI=1S/C21H21N3O4/c1-14-4-3-5-15(12-14)20(25)23(16-6-7-16)13-19-21(26)28-22-24(19)17-8-10-18(27-2)11-9-17/h3-5,8-12,16H,6-7,13H2,1-2H3 | Cc1cccc(c1)C(=O)N(Cc2c(on[n+]2c3ccc(cc3)OC)[O-])C4CC4 | |
| AKOS005250290 | 379.409 | C21 H21 N3 O4 | DYIMRDYSEDOKRA-UHFFFAOYSA-N | InChI=1S/C21H21N3O4/c1-14-3-5-15(6-4-14)20(25)23(16-7-8-16)13-19-21(26)28-22-24(19)17-9-11-18(27-2)12-10-17/h3-6,9-12,16H,7-8,13H2,1-2H3 | Cc1ccc(cc1)C(=O)N(Cc2c(on[n+]2c3ccc(cc3)OC)[O-])C4CC4 | |
| AKOS005250345 | 379.409 | C21 H21 N3 O4 | QLKUQPRLKXIFQV-UHFFFAOYSA-N | InChI=1S/C21H21N3O4/c1-27-18-11-9-17(10-12-18)24-19(21(26)28-22-24)14-23(16-7-8-16)20(25)13-15-5-3-2-4-6-15/h2-6,9-12,16H,7-8,13-14H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)Cc4ccccc4 | |
| AKOS005250305 | 395.409 | C21 H21 N3 O5 | CFGNRRNGROPIJN-UHFFFAOYSA-N | InChI=1S/C21H21N3O5/c1-27-17-10-8-16(9-11-17)24-19(21(26)29-22-24)13-23(15-6-7-15)20(25)14-4-3-5-18(12-14)28-2/h3-5,8-12,15H,6-7,13H2,1-2H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4cccc(c4)OC | |
| AKOS005250308 | 395.409 | C21 H21 N3 O5 | FXKBQZPVSLLHJP-UHFFFAOYSA-N | InChI=1S/C21H21N3O5/c1-27-17-9-6-10-18(28-2)19(17)20(25)23(14-11-12-14)13-16-21(26)29-22-24(16)15-7-4-3-5-8-15/h3-10,14H,11-13H2,1-2H3 | COc1cccc(c1C(=O)N(Cc2c(on[n+]2c3ccccc3)[O-])C4CC4)OC | |
| AKOS005250312 | 395.409 | C21 H21 N3 O5 | ZVNPGVVVPHYPSB-UHFFFAOYSA-N | InChI=1S/C21H21N3O5/c1-27-17-9-3-14(4-10-17)20(25)23(15-5-6-15)13-19-21(26)29-22-24(19)16-7-11-18(28-2)12-8-16/h3-4,7-12,15H,5-6,13H2,1-2H3 | COc1ccc(cc1)C(=O)N(Cc2c(on[n+]2c3ccc(cc3)OC)[O-])C4CC4 | |
| AKOS005250337 | 395.409 | C21 H21 N3 O5 | NRSXLENAXJJUDK-UHFFFAOYSA-N | InChI=1S/C21H21N3O5/c1-27-17-11-9-16(10-12-17)24-19(21(26)29-22-24)13-23(15-7-8-15)20(25)14-28-18-5-3-2-4-6-18/h2-6,9-12,15H,7-8,13-14H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)COc4ccccc4 | |
| AKOS005250338 | 395.409 | C21 H21 N3 O5 | SWUMRDRLNLNOOE-UHFFFAOYSA-N | InChI=1S/C21H21N3O5/c1-27-18-11-8-14(12-19(18)28-2)20(25)23(15-9-10-15)13-17-21(26)29-22-24(17)16-6-4-3-5-7-16/h3-8,11-12,15H,9-10,13H2,1-2H3 | COc1ccc(cc1OC)C(=O)N(Cc2c(on[n+]2c3ccccc3)[O-])C4CC4 | |
| AKOS005250561 | 427.474 | C21 H21 N3 O5 S | CTQWDYRJZDORTN-UHFFFAOYSA-N | InChI=1S/C21H21N3O5S/c1-3-28-20(26)16-14-10-9-13(12-7-5-4-6-8-12)11-15(14)30-19(16)22-18(25)17-21(27)29-23-24(17)2/h4-8,13H,3,9-11H2,1-2H3,(H-,22,23,25,26,27) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3C)[O-])CC(CC2)c4ccccc4 | |
| AKOS005251187 | 427.474 | C21 H21 N3 O5 S | AVIQCWPCBVMNKW-UHFFFAOYSA-N | InChI=1S/C21H21N3O5S/c1-2-3-13-28-20(26)15-9-11-16(12-10-15)22-18(25)14-30-19-21(27)29-23-24(19)17-7-5-4-6-8-17/h4-12H,2-3,13-14H2,1H3,(H-,22,23,25,26,27) | CCCCOC(=O)c1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252060 | 427.474 | C21 H21 N3 O5 S | WKFSDTKQXWJRNQ-UHFFFAOYSA-N | InChI=1S/C21H21N3O5S/c1-3-17(18(25)22-15-12-10-14(11-13-15)20(26)28-4-2)30-19-21(27)29-23-24(19)16-8-6-5-7-9-16/h5-13,17H,3-4H2,1-2H3,(H-,22,23,25,26,27) | CCC(C(=O)Nc1ccc(cc1)C(=O)OCC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252076 | 427.474 | C21 H21 N3 O5 S | VWKXUWARLINRCC-UHFFFAOYSA-N | InChI=1S/C21H21N3O5S/c1-4-18(19(26)22-15-7-5-14(6-8-15)13(2)25)30-20-21(27)29-23-24(20)16-9-11-17(28-3)12-10-16/h5-12,18H,4H2,1-3H3,(H-,22,23,25,26,27) | CCC(C(=O)Nc1ccc(cc1)C(=O)C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251580 | 459.539 | C21 H21 N3 O5 S2 | KANQGUZVLZYYGX-UHFFFAOYSA-N | InChI=1S/C21H21N3O5S2/c1-12-8-9-14-15(10-12)31-18(17(14)20(26)28-2)22-16(25)11-30-19-21(27)29-23-24(19)13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3,(H-,22,23,25,26,27) | CC1CCc2c(sc(c2C(=O)OC)NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005251592 | 459.539 | C21 H21 N3 O5 S2 | IAJMGPLPBUTLMC-UHFFFAOYSA-N | InChI=1S/C21H21N3O5S2/c1-24-19(21(27)29-23-24)30-11-16(25)22-18-17(20(26)28-2)14-9-8-13(10-15(14)31-18)12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3,(H-,22,23,25,26,27) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2c(c3c(s2)CC(CC3)c4ccccc4)C(=O)OC | |
| AKOS005251596 | 459.539 | C21 H21 N3 O5 S2 | PDFPMFZGLCBACB-UHFFFAOYSA-N | InChI=1S/C21H21N3O5S2/c1-2-28-20(26)17-14-10-6-7-11-15(14)31-18(17)22-16(25)12-30-19-21(27)29-23-24(19)13-8-4-3-5-9-13/h3-5,8-9H,2,6-7,10-12H2,1H3,(H-,22,23,25,26,27) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])CCCC2 | |
| AKOS005251618 | 459.539 | C21 H21 N3 O5 S2 | YLHXBBYQJXNODW-UHFFFAOYSA-N | InChI=1S/C21H21N3O5S2/c1-28-20(26)17-14-10-6-3-7-11-15(14)31-18(17)22-16(25)12-30-19-21(27)29-23-24(19)13-8-4-2-5-9-13/h2,4-5,8-9H,3,6-7,10-12H2,1H3,(H-,22,23,25,26,27) | COC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])CCCCC2 | |
| AKOS005251668 | 459.539 | C21 H21 N3 O5 S2 | NKQHVBWUSIWINF-UHFFFAOYSA-N | InChI=1S/C21H21N3O5S2/c1-12(30-19-21(27)29-23-24(19)13-8-4-3-5-9-13)17(25)22-18-16(20(26)28-2)14-10-6-7-11-15(14)31-18/h3-5,8-9,12H,6-7,10-11H2,1-2H3,(H-,22,23,25,26,27) | CC(C(=O)Nc1c(c2c(s1)CCCC2)C(=O)OC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252561 | 459.539 | C21 H21 N3 O5 S2 | UQAIQGCOLANIAG-UHFFFAOYSA-N | InChI=1S/C21H21N3O5S2/c1-28-20(26)17-14-9-5-6-10-15(14)31-18(17)22-16(25)11-12-30-19-21(27)29-23-24(19)13-7-3-2-4-8-13/h2-4,7-8H,5-6,9-12H2,1H3,(H-,22,23,25,26,27) | COC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])CCCC2 | |
| AKOS005250145 | 411.408 | C21 H21 N3 O6 | CQZOALBKNUCHPB-UHFFFAOYSA-N | InChI=1S/C21H21N3O6/c1-3-4-13-29-20(26)14-5-7-15(8-6-14)22-19(25)18-21(27)30-23-24(18)16-9-11-17(28-2)12-10-16/h5-12H,3-4,13H2,1-2H3,(H-,22,23,25,26,27) | CCCCOC(=O)c1ccc(cc1)NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250147 | 443.473 | C21 H21 N3 O6 S | FYAUQEGPZKGMBY-UHFFFAOYSA-N | InChI=1S/C21H21N3O6S/c1-11-4-9-14-15(10-11)31-19(16(14)20(26)29-3)22-18(25)17-21(27)30-23-24(17)12-5-7-13(28-2)8-6-12/h5-8,11H,4,9-10H2,1-3H3,(H-,22,23,25,26,27) | CC1CCc2c(sc(c2C(=O)OC)NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005250179 | 443.473 | C21 H21 N3 O6 S | JDIWEXGSLFBCDS-UHFFFAOYSA-N | InChI=1S/C21H21N3O6S/c1-3-29-20(26)16-14-6-4-5-7-15(14)31-19(16)22-18(25)17-21(27)30-23-24(17)12-8-10-13(28-2)11-9-12/h8-11H,3-7H2,1-2H3,(H-,22,23,25,26,27) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])CCCC2 | |
| AKOS005250201 | 443.473 | C21 H21 N3 O6 S | IOZPUKIZTWBKCV-UHFFFAOYSA-N | InChI=1S/C21H21N3O6S/c1-28-13-10-8-12(9-11-13)24-17(21(27)30-23-24)18(25)22-19-16(20(26)29-2)14-6-4-3-5-7-15(14)31-19/h8-11H,3-7H2,1-2H3,(H-,22,23,25,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3c(c4c(s3)CCCCC4)C(=O)OC | |
| AKOS005251859 | 443.473 | C21 H21 N3 O6 S | KTROJDDEQROUOV-UHFFFAOYSA-N | InChI=1S/C21H21N3O6S/c1-4-29-20(26)14-5-7-15(8-6-14)22-18(25)13(2)31-19-21(27)30-23-24(19)16-9-11-17(28-3)12-10-16/h5-13H,4H2,1-3H3,(H-,22,23,25,26,27) | CCOC(=O)c1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251907 | 443.473 | C21 H21 N3 O6 S | SRXVKALJSXDIBE-UHFFFAOYSA-N | InChI=1S/C21H21N3O6S/c1-4-17(18(25)22-16-11-13(20(26)27)6-5-12(16)2)31-19-21(28)30-23-24(19)14-7-9-15(29-3)10-8-14/h5-11,17H,4H2,1-3H3,(H2-,22,23,25,26,27,28) | CCC(C(=O)Nc1cc(ccc1C)C(=O)O)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251927 | 443.473 | C21 H21 N3 O6 S | YENUEHYCNQSKBF-UHFFFAOYSA-N | InChI=1S/C21H21N3O6S/c1-3-18(19(25)22-13-4-9-16-17(12-13)29-11-10-28-16)31-20-21(26)30-23-24(20)14-5-7-15(27-2)8-6-14/h4-9,12,18H,3,10-11H2,1-2H3,(H-,22,23,25,26) | CCC(C(=O)Nc1ccc2c(c1)OCCO2)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252041 | 443.473 | C21 H21 N3 O6 S | GWWRIXCRGWKPOI-UHFFFAOYSA-N | InChI=1S/C21H21N3O6S/c1-4-17(18(25)22-16-8-6-5-7-15(16)20(26)29-3)31-19-21(27)30-23-24(19)13-9-11-14(28-2)12-10-13/h5-12,17H,4H2,1-3H3,(H-,22,23,25,26,27) | CCC(C(=O)Nc1ccccc1C(=O)OC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252226 | 443.473 | C21 H21 N3 O6 S | MGSPDNZABCMPIV-UHFFFAOYSA-N | InChI=1S/C21H21N3O6S/c1-3-29-20(26)14-4-6-15(7-5-14)22-18(25)12-13-31-19-21(27)30-23-24(19)16-8-10-17(28-2)11-9-16/h4-11H,3,12-13H2,1-2H3,(H-,22,23,25,26,27) | CCOC(=O)c1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251520 | 475.538 | C21 H21 N3 O6 S2 | FRPSQPRVDROSHQ-UHFFFAOYSA-N | InChI=1S/C21H21N3O6S2/c1-28-13-9-7-12(8-10-13)24-19(21(27)30-23-24)31-11-16(25)22-18-17(20(26)29-2)14-5-3-4-6-15(14)32-18/h7-10H,3-6,11H2,1-2H3,(H-,22,23,25,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3c(c4c(s3)CCCC4)C(=O)OC | |
| AKOS005251936 | 459.472 | C21 H21 N3 O7 S | DAHDTJPTPPQJBS-UHFFFAOYSA-N | InChI=1S/C21H21N3O7S/c1-4-17(18(25)22-15-10-5-12(20(26)27)11-16(15)30-3)32-19-21(28)31-23-24(19)13-6-8-14(29-2)9-7-13/h5-11,17H,4H2,1-3H3,(H2-,22,23,25,26,27,28) | CCC(C(=O)Nc1ccc(cc1OC)C(=O)O)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251824 | 455.553 | C21 H21 N5 O3 S2 | XWBRMLKEPMVSDS-UHFFFAOYSA-N | InChI=1S/C21H21N5O3S2/c1-13(30-20-21(28)29-24-25(20)2)18(27)23-19-16(10-22)15-8-9-26(12-17(15)31-19)11-14-6-4-3-5-7-14/h3-7,13H,8-9,11-12H2,1-2H3,(H-,23,24,27,28) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)Cc3ccccc3)C#N)Sc4c(on[n+]4C)[O-] | |
| AKOS005252538 | 455.553 | C21 H21 N5 O3 S2 | SECKORLJQOPWJT-UHFFFAOYSA-N | InChI=1S/C21H21N5O3S2/c1-25-20(21(28)29-24-25)30-10-8-18(27)23-19-16(11-22)15-7-9-26(13-17(15)31-19)12-14-5-3-2-4-6-14/h2-6H,7-10,12-13H2,1H3,(H-,23,24,27,28) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2c(c3c(s2)CN(CC3)Cc4ccccc4)C#N | |
| AKOS005250921 | 471.486 | C21 H21 N5 O6 S | ZFNQZGPXYLMNDK-UHFFFAOYSA-O | InChI=1S/C21H20N5O6S/c1-26-18(21(29)32-25-26)13-17(24-19(27)15-5-3-2-4-6-15)20(28)23-12-11-14-7-9-16(10-8-14)33(22,30)31/h2-10,13H,11-12H2,1H3,(H3,22,23,28,30,31)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCc2ccc(cc2)S(=O)(=O)N)\NC(=O)c3ccccc3 | |
| AKOS005253574 | 487.486 | C21 H21 N5 O7 S | BAZOKLMAPIFIAS-UHFFFAOYSA-N | InChI=1S/C21H21N5O7S/c22-34(30,31)16-8-6-14(7-9-16)23-19(27)12-18-20(28)25(10-11-32-18)13-17-21(29)33-24-26(17)15-4-2-1-3-5-15/h1-9,18H,10-13H2,(H3-,22,23,24,27,29,30,31) | c1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)S(=O)(=O)N | |
| AKOS005250948 | 435.436 | C21 H21 N7 O4 | GQQSLKGKBODLFP-UHFFFAOYSA-O | InChI=1S/C21H20N7O4/c1-26-17(20(31)32-25-26)14-16(24-18(29)15-6-3-2-4-7-15)19(30)27-10-12-28(13-11-27)21-22-8-5-9-23-21/h2-9,14H,10-13H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCN(CC2)c3ncccn3)\NC(=O)c4ccccc4 | |
| AKOS005252043 | 463.934 | C21 H22 Cl N3 O5 S | OYQOUPMGKPKZQC-UHFFFAOYSA-N | InChI=1S/C21H22ClN3O5S/c1-5-18(19(26)23-16-10-12(2)15(22)11-17(16)29-4)31-20-21(27)30-24-25(20)13-6-8-14(28-3)9-7-13/h6-11,18H,5H2,1-4H3,(H-,23,24,26,27) | CCC(C(=O)Nc1cc(c(cc1OC)Cl)C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252091 | 479.934 | C21 H22 Cl N3 O6 S | FOVZKPCRYOIIDD-UHFFFAOYSA-N | InChI=1S/C21H22ClN3O6S/c1-5-18(19(26)23-15-10-14(22)16(29-3)11-17(15)30-4)32-20-21(27)31-24-25(20)12-6-8-13(28-2)9-7-12/h6-11,18H,5H2,1-4H3,(H-,23,24,26,27) | CCC(C(=O)Nc1cc(c(cc1OC)OC)Cl)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005250481 | 378.424 | C21 H22 N4 O3 | VDWBOKLRVQLWEJ-UHFFFAOYSA-N | InChI=1S/C21H22N4O3/c1-15-8-9-16(2)18(14-15)23-10-12-24(13-11-23)20(26)19-21(27)28-22-25(19)17-6-4-3-5-7-17/h3-9,14H,10-13H2,1-2H3 | Cc1ccc(c(c1)N2CCN(CC2)C(=O)c3c(on[n+]3c4ccccc4)[O-])C | |
| AKOS005219824 | 410.489 | C21 H22 N4 O3 S | IRKURSVWIIDPCB-UHFFFAOYSA-N | InChI=1S/C21H22N4O3S/c1-27-18-11-9-17(10-12-18)25-19(20(26)28-23-25)14-24(21(29)22-16-7-8-16)13-15-5-3-2-4-6-15/h2-6,9-12,16H,7-8,13-14H2,1H3,(H-,22,23,26,29) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(Cc3ccccc3)C(=S)NC4CC4 | |
| AKOS005250610 | 394.424 | C21 H22 N4 O4 | SJQJAUZKQYIDIZ-UHFFFAOYSA-N | InChI=1S/C21H22N4O4/c1-15-3-5-16(6-4-15)23-11-13-24(14-12-23)20(26)19-21(27)29-22-25(19)17-7-9-18(28-2)10-8-17/h3-10H,11-14H2,1-2H3 | Cc1ccc(cc1)N2CCN(CC2)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005250626 | 394.424 | C21 H22 N4 O4 | PGKBMETVPIDTOS-UHFFFAOYSA-N | InChI=1S/C21H22N4O4/c1-28-18-9-7-17(8-10-18)25-19(21(27)29-22-25)20(26)24-13-11-23(12-14-24)15-16-5-3-2-4-6-16/h2-10H,11-15H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)Cc4ccccc4 | |
| AKOS005250102 | 410.423 | C21 H22 N4 O5 | KIVWUFLCYJMGSG-UHFFFAOYSA-N | InChI=1S/C21H22N4O5/c1-23-18(21(29)30-22-23)13-25(12-16-8-4-2-5-9-16)19(26)14-24(15-20(27)28)17-10-6-3-7-11-17/h2-11H,12-15H2,1H3,(H-,22,27,28,29) | C[n+]1c(c(on1)[O-])CN(Cc2ccccc2)C(=O)CN(CC(=O)O)c3ccccc3 | |
| AKOS005250589 | 442.488 | C21 H22 N4 O5 S | OJSKJZMDZVHCPU-UHFFFAOYSA-N | InChI=1S/C21H22N4O5S/c1-3-29-20(27)16-14-9-10-25(11-13-7-5-4-6-8-13)12-15(14)31-19(16)22-18(26)17-21(28)30-23-24(17)2/h4-8H,3,9-12H2,1-2H3,(H-,22,23,26,27,28) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3C)[O-])CN(CC2)Cc4ccccc4 | |
| AKOS005252004 | 442.488 | C21 H22 N4 O5 S | FHHSHVXUOZJBGE-UHFFFAOYSA-N | InChI=1S/C21H22N4O5S/c1-4-18(19(27)23-15-7-5-14(6-8-15)22-13(2)26)31-20-21(28)30-24-25(20)16-9-11-17(29-3)12-10-16/h5-12,18,24,28H,4H2,1-3H3 | CCC(C(=O)Nc1ccc(cc1)NC(=O)C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251616 | 474.553 | C21 H22 N4 O5 S2 | ADSGWGBBWUZJJF-UHFFFAOYSA-N | InChI=1S/C21H22N4O5S2/c1-24-19(21(28)30-23-24)31-12-16(26)22-18-17(20(27)29-2)14-8-9-25(11-15(14)32-18)10-13-6-4-3-5-7-13/h3-7H,8-12H2,1-2H3,(H-,22,23,26,27,28) | C[n+]1c(c(on1)[O-])SCC(=O)Nc2c(c3c(s2)CN(CC3)Cc4ccccc4)C(=O)OC | |
| AKOS005219808 | 426.423 | C21 H22 N4 O6 | YGGCSHMLFZGHTJ-UHFFFAOYSA-N | InChI=1S/C21H22N4O6/c1-23(12-18-21(29)31-22-25(18)16-6-4-3-5-7-16)19(26)13-24(14-20(27)28)15-8-10-17(30-2)11-9-15/h3-11H,12-14H2,1-2H3,(H-,22,27,28,29) | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)CN(CC(=O)O)c3ccc(cc3)OC | |
| AKOS005219827 | 426.423 | C21 H22 N4 O6 | STZVESRPFFOOBB-UHFFFAOYSA-N | InChI=1S/C21H22N4O6/c1-23(12-18-21(29)31-22-25(18)15-7-4-3-5-8-15)19(26)13-24(14-20(27)28)16-9-6-10-17(11-16)30-2/h3-11H,12-14H2,1-2H3,(H-,22,27,28,29) | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)CN(CC(=O)O)c3cccc(c3)OC | |
| AKOS005250096 | 426.423 | C21 H22 N4 O6 | DFPGNSBQEZQUTR-UHFFFAOYSA-N | InChI=1S/C21H22N4O6/c1-23(19(26)13-24(14-20(27)28)15-6-4-3-5-7-15)12-18-21(29)31-22-25(18)16-8-10-17(30-2)11-9-16/h3-11H,12-14H2,1-2H3,(H-,22,27,28,29) | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)CN(CC(=O)O)c3ccccc3 | |
| AKOS005251746 | 490.553 | C21 H22 N4 O6 S2 | VYUMYAAJVSQQJP-UHFFFAOYSA-N | InChI=1S/C21H22N4O6S2/c1-5-30-20(28)14-11(2)15(17(27)22-13-9-7-6-8-10-13)33-18(14)23-16(26)12(3)32-19-21(29)31-24-25(19)4/h6-10,12H,5H2,1-4H3,(H2-,22,23,24,26,27,28,29) | CCOC(=O)c1c(c(sc1NC(=O)C(C)Sc2c(on[n+]2C)[O-])C(=O)Nc3ccccc3)C | |
| AKOS005251961 | 490.553 | C21 H22 N4 O6 S2 | KEWHTZWVEMEFGS-UHFFFAOYSA-N | InChI=1S/C21H22N4O6S2/c1-5-13(32-19-21(29)31-24-25(19)3)16(26)23-18-14(20(28)30-4)11(2)15(33-18)17(27)22-12-9-7-6-8-10-12/h6-10,13H,5H2,1-4H3,(H2-,22,23,24,26,27,28,29) | CCC(C(=O)Nc1c(c(c(s1)C(=O)Nc2ccccc2)C)C(=O)OC)Sc3c(on[n+]3C)[O-] | |
| AKOS005252663 | 490.553 | C21 H22 N4 O6 S2 | AGEDYGVPKQXSCP-UHFFFAOYSA-N | InChI=1S/C21H22N4O6S2/c1-4-30-20(28)15-12(2)16(17(27)22-13-8-6-5-7-9-13)33-18(15)23-14(26)10-11-32-19-21(29)31-24-25(19)3/h5-9H,4,10-11H2,1-3H3,(H2-,22,23,24,26,27,28,29) | CCOC(=O)c1c(c(sc1NC(=O)CCSc2c(on[n+]2C)[O-])C(=O)Nc3ccccc3)C | |
| AKOS005215614 | 460.304 | C21 H23 Br N3 O2 P | MRSBGZGJZVOGNR-UHFFFAOYSA-N | InChI=1S/C21H23BrN3O2P/c1-3-4-15-25-21(20(27-24-25)23-19(26)16(2)22)28(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,16H,3-4,15H2,1-2H3 | CCCC[n+]1c(c(on1)[N-]C(=O)C(C)Br)P(c2ccccc2)c3ccccc3 | |
| AKOS005252051 | 397.491 | C21 H23 N3 O3 S | PEVAGRCKALAVLC-UHFFFAOYSA-N | InChI=1S/C21H23N3O3S/c1-4-18(19(25)22-16-12-10-15(11-13-16)14(2)3)28-20-21(26)27-23-24(20)17-8-6-5-7-9-17/h5-14,18H,4H2,1-3H3,(H-,22,23,25,26) | CCC(C(=O)Nc1ccc(cc1)C(C)C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252064 | 397.491 | C21 H23 N3 O3 S | FFDZHTNDYROIPJ-UHFFFAOYSA-N | InChI=1S/C21H23N3O3S/c1-4-15-11-9-10-14(3)18(15)22-19(25)17(5-2)28-20-21(26)27-23-24(20)16-12-7-6-8-13-16/h6-13,17H,4-5H2,1-3H3,(H-,22,23,25,26) | CCc1cccc(c1NC(=O)C(CC)Sc2c(on[n+]2c3ccccc3)[O-])C | |
| AKOS005251837 | 413.49 | C21 H23 N3 O4 S | FCTSMNADKBNKHC-UHFFFAOYSA-N | InChI=1S/C21H23N3O4S/c1-5-15-8-6-7-13(2)18(15)22-19(25)14(3)29-20-21(26)28-23-24(20)16-9-11-17(27-4)12-10-16/h6-12,14H,5H2,1-4H3,(H-,22,23,25,26) | CCc1cccc(c1NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005251858 | 413.49 | C21 H23 N3 O4 S | GHSCYGIMSXBNSR-UHFFFAOYSA-N | InChI=1S/C21H23N3O4S/c1-13(2)15-5-7-16(8-6-15)22-19(25)14(3)29-20-21(26)28-23-24(20)17-9-11-18(27-4)12-10-17/h5-14H,1-4H3,(H-,22,23,25,26) | CC(C)c1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251885 | 413.49 | C21 H23 N3 O4 S | DORZYCAHMMRHEP-UHFFFAOYSA-N | InChI=1S/C21H23N3O4S/c1-3-4-14-27-18-12-10-16(11-13-18)22-19(25)15(2)29-20-21(26)28-23-24(20)17-8-6-5-7-9-17/h5-13,15H,3-4,14H2,1-2H3,(H-,22,23,25,26) | CCCCOc1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252017 | 413.49 | C21 H23 N3 O4 S | WNJXUWBBEAUJOL-UHFFFAOYSA-N | InChI=1S/C21H23N3O4S/c1-5-18(19(25)22-17-11-6-13(2)12-14(17)3)29-20-21(26)28-23-24(20)15-7-9-16(27-4)10-8-15/h6-12,18H,5H2,1-4H3,(H-,22,23,25,26) | CCC(C(=O)Nc1ccc(cc1C)C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252020 | 413.49 | C21 H23 N3 O4 S | HQXYZYGKUZPCRZ-UHFFFAOYSA-N | InChI=1S/C21H23N3O4S/c1-5-18(19(25)22-15-11-13(2)10-14(3)12-15)29-20-21(26)28-23-24(20)16-6-8-17(27-4)9-7-16/h6-12,18H,5H2,1-4H3,(H-,22,23,25,26) | CCC(C(=O)Nc1cc(cc(c1)C)C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252093 | 413.49 | C21 H23 N3 O4 S | CHIYSHOKOIWUPU-UHFFFAOYSA-N | InChI=1S/C21H23N3O4S/c1-5-17(19(25)22-18-13(2)7-6-8-14(18)3)29-20-21(26)28-23-24(20)15-9-11-16(27-4)12-10-15/h6-12,17H,5H2,1-4H3,(H-,22,23,25,26) | CCC(C(=O)Nc1c(cccc1C)C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252122 | 413.49 | C21 H23 N3 O4 S | LHELFJADVSOQIK-UHFFFAOYSA-N | InChI=1S/C21H23N3O4S/c1-5-18(19(25)22-17-12-13(2)6-7-14(17)3)29-20-21(26)28-23-24(20)15-8-10-16(27-4)11-9-15/h6-12,18H,5H2,1-4H3,(H-,22,23,25,26) | CCC(C(=O)Nc1cc(ccc1C)C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252128 | 413.49 | C21 H23 N3 O4 S | WWSFJHJVQXANMF-UHFFFAOYSA-N | InChI=1S/C21H23N3O4S/c1-5-18(19(25)22-17-8-6-7-13(2)14(17)3)29-20-21(26)28-23-24(20)15-9-11-16(27-4)12-10-15/h6-12,18H,5H2,1-4H3,(H-,22,23,25,26) | CCC(C(=O)Nc1cccc(c1C)C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252137 | 413.49 | C21 H23 N3 O4 S | AWUSMHQUXVQSLW-UHFFFAOYSA-N | InChI=1S/C21H23N3O4S/c1-5-18(19(25)22-15-7-6-13(2)14(3)12-15)29-20-21(26)28-23-24(20)16-8-10-17(27-4)11-9-16/h6-12,18H,5H2,1-4H3,(H-,22,23,25,26) | CCC(C(=O)Nc1ccc(c(c1)C)C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252196 | 413.49 | C21 H23 N3 O4 S | IZSFPYBRAOECPQ-UHFFFAOYSA-N | InChI=1S/C21H23N3O4S/c1-4-15-7-5-6-14(2)19(15)22-18(25)12-13-29-20-21(26)28-23-24(20)16-8-10-17(27-3)11-9-16/h5-11H,4,12-13H2,1-3H3,(H-,22,23,25,26) | CCc1cccc(c1NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005252225 | 413.49 | C21 H23 N3 O4 S | YJLBPKNZZCHAQX-UHFFFAOYSA-N | InChI=1S/C21H23N3O4S/c1-14(2)15-4-6-16(7-5-15)22-19(25)12-13-29-20-21(26)28-23-24(20)17-8-10-18(27-3)11-9-17/h4-11,14H,12-13H2,1-3H3,(H-,22,23,25,26) | CC(C)c1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252251 | 413.49 | C21 H23 N3 O4 S | XWLKTFKUZZMJKC-UHFFFAOYSA-N | InChI=1S/C21H23N3O4S/c1-2-3-14-27-18-11-9-16(10-12-18)22-19(25)13-15-29-20-21(26)28-23-24(20)17-7-5-4-6-8-17/h4-12H,2-3,13-15H2,1H3,(H-,22,23,25,26) | CCCCOc1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251548 | 429.489 | C21 H23 N3 O5 S | XCINQYNOCIGCQC-UHFFFAOYSA-N | InChI=1S/C21H23N3O5S/c1-3-4-13-28-18-9-5-15(6-10-18)22-19(25)14-30-20-21(26)29-23-24(20)16-7-11-17(27-2)12-8-16/h5-12H,3-4,13-14H2,1-2H3,(H-,22,23,25,26) | CCCCOc1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252050 | 429.489 | C21 H23 N3 O5 S | UAMVJVWAFDMBEI-UHFFFAOYSA-N | InChI=1S/C21H23N3O5S/c1-4-18(19(25)22-16-8-6-7-9-17(16)28-5-2)30-20-21(26)29-23-24(20)14-10-12-15(27-3)13-11-14/h6-13,18H,4-5H2,1-3H3,(H-,22,23,25,26) | CCC(C(=O)Nc1ccccc1OCC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252105 | 429.489 | C21 H23 N3 O5 S | ITCBJVAOPDOVJA-UHFFFAOYSA-N | InChI=1S/C21H23N3O5S/c1-4-18(19(25)22-14-6-10-17(11-7-14)28-5-2)30-20-21(26)29-23-24(20)15-8-12-16(27-3)13-9-15/h6-13,18H,4-5H2,1-3H3,(H-,22,23,25,26) | CCC(C(=O)Nc1ccc(cc1)OCC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252054 | 445.489 | C21 H23 N3 O6 S | XRVRHUGZCGMSCC-UHFFFAOYSA-N | InChI=1S/C21H23N3O6S/c1-5-18(19(25)22-16-11-10-15(28-3)12-17(16)29-4)31-20-21(26)30-23-24(20)13-6-8-14(27-2)9-7-13/h6-12,18H,5H2,1-4H3,(H-,22,23,25,26) | CCC(C(=O)Nc1ccc(cc1OC)OC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252069 | 445.489 | C21 H23 N3 O6 S | YJRFYLVVRIFGAQ-UHFFFAOYSA-N | InChI=1S/C21H23N3O6S/c1-5-18(19(25)22-16-12-15(28-3)10-11-17(16)29-4)31-20-21(26)30-23-24(20)13-6-8-14(27-2)9-7-13/h6-12,18H,5H2,1-4H3,(H-,22,23,25,26) | CCC(C(=O)Nc1cc(ccc1OC)OC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252078 | 445.489 | C21 H23 N3 O6 S | ZUZCOLMHORPEIE-UHFFFAOYSA-N | InChI=1S/C21H23N3O6S/c1-5-18(19(25)22-13-10-16(28-3)12-17(11-13)29-4)31-20-21(26)30-23-24(20)14-6-8-15(27-2)9-7-14/h6-12,18H,5H2,1-4H3,(H-,22,23,25,26) | CCC(C(=O)Nc1cc(cc(c1)OC)OC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005253485 | 473.502 | C21 H23 N5 O6 S | YVISTKTTXAIRKK-UHFFFAOYSA-N | InChI=1S/C21H23N5O6S/c1-3-31-19(29)12-4-6-13(7-5-12)22-17(27)10-15-18(28)26(14-8-9-14)21(33)25(15)11-16-20(30)32-23-24(16)2/h4-7,14-15H,3,8-11H2,1-2H3,(H-,22,23,27,29,30) | CCOC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])C4CC4 | |
| AKOS005214233 | 364.441 | C21 H24 N4 O2 | VKDYOQFJMHGRAX-UHFFFAOYSA-N | InChI=1S/C21H24N4O2/c26-21-20(25(23-27-21)19-9-5-2-6-10-19)15-22-18-11-13-24(14-12-18)16-17-7-3-1-4-8-17/h1-10,18,22H,11-16H2 | c1ccc(cc1)CN2CCC(CC2)NCc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250927 | 396.44 | C21 H24 N4 O4 | LQVAPXUNQZJBAB-UHFFFAOYSA-O | InChI=1S/C21H23N4O4/c1-25-18(21(28)29-24-25)14-17(23-19(26)16-10-6-3-7-11-16)20(27)22-13-12-15-8-4-2-5-9-15/h3,6-8,10-11,14H,2,4-5,9,12-13H2,1H3,(H,22,27)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCC2=CCCCC2)\NC(=O)c3ccccc3 | |
| AKOS005250934 | 428.438 | C21 H24 N4 O6 | XUEDTVVKANEOKL-UHFFFAOYSA-O | InChI=1S/C21H23N4O6/c1-3-30-20(28)15-9-11-25(12-10-15)19(27)16(13-17-21(29)31-23-24(17)2)22-18(26)14-7-5-4-6-8-14/h4-8,13,15H,3,9-12H2,1-2H3/q-1/p+1 | CCOC(=O)C1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2C)[O-])/NC(=O)c3ccccc3 | |
| AKOS005250941 | 428.438 | C21 H24 N4 O6 | YVIYCWMQUSOTTO-UHFFFAOYSA-O | InChI=1S/C21H23N4O6/c1-3-30-20(28)15-10-7-11-25(13-15)19(27)16(12-17-21(29)31-23-24(17)2)22-18(26)14-8-5-4-6-9-14/h4-6,8-9,12,15H,3,7,10-11,13H2,1-2H3/q-1/p+1 | CCOC(=O)C1CCCN(C1)C(=O)/C(=C/c2c(on[n+]2C)[O-])/NC(=O)c3ccccc3 | |
| AKOS005253102 | 426.535 | C21 H26 N6 O2 S | PWQRPNQITKXXKT-UHFFFAOYSA-N | InChI=1S/C21H26N6O2S/c22-13-17-12-16-8-4-1-2-5-9-18(16)23-21(17)30-15-19(28)24-20-14-27(25-29-20)26-10-6-3-7-11-26/h12,14H,1-11,15H2 | c1c2c(nc(c1C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)CCCCCC2 | |
| AKOS005252852 | 413.536 | C21 H27 N5 O2 S | PYDDVSBDYQFVQA-UHFFFAOYSA-N | InChI=1S/C21H27N5O2S/c1-13(2)26-11-19(28-25-26)24-18(27)12-29-20-15(10-22)8-14-9-16(21(3,4)5)6-7-17(14)23-20/h8,11,13,16H,6-7,9,12H2,1-5H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCC(C3)C(C)(C)C)C#N | |
| AKOS005253397 | 429.536 | C21 H27 N5 O3 S | NRFBVTMECQCQNQ-UHFFFAOYSA-N | InChI=1S/C21H27N5O3S/c1-21(2,3)16-5-6-17-14(10-16)9-15(11-22)20(23-17)30-13-18(27)24-19-12-26(25-29-19)7-8-28-4/h9,12,16H,5-8,10,13H2,1-4H3 | CC(C)(C)C1CCc2c(cc(c(n2)SCC(=O)[N-]c3c[n+](no3)CCOC)C#N)C1 | |
| AKOS005251657 | 512.6 | C21 H28 N4 O7 S2 | FDKQJXGMOOTRTD-UHFFFAOYSA-N | InChI=1S/C21H28N4O7S2/c1-7-30-18(27)14-12-8-9-25(20(29)31-21(3,4)5)10-13(12)34-16(14)22-15(26)11(2)33-17-19(28)32-23-24(17)6/h11H,7-10H2,1-6H3,(H-,22,23,26,27,28) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3C)[O-])CN(CC2)C(=O)OC(C)(C)C | |
| AKOS005251954 | 512.6 | C21 H28 N4 O7 S2 | UIOGQICXNNVLEW-UHFFFAOYSA-N | InChI=1S/C21H28N4O7S2/c1-7-12(34-17-19(28)32-23-24(17)5)15(26)22-16-14(18(27)30-6)11-8-9-25(10-13(11)33-16)20(29)31-21(2,3)4/h12H,7-10H2,1-6H3,(H-,22,23,26,27,28) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)OC(C)(C)C)C(=O)OC)Sc3c(on[n+]3C)[O-] | |
| AKOS005252655 | 512.6 | C21 H28 N4 O7 S2 | WYVKLZOWTYSQER-UHFFFAOYSA-N | InChI=1S/C21H28N4O7S2/c1-6-30-18(27)15-12-7-9-25(20(29)31-21(2,3)4)11-13(12)34-16(15)22-14(26)8-10-33-17-19(28)32-23-24(17)5/h6-11H2,1-5H3,(H-,22,23,26,27,28) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3C)[O-])CN(CC2)C(=O)OC(C)(C)C | |
| AKOS005251758 | 467.602 | C21 H29 N3 O5 S2 | PLRJQCXBWFGFHM-UHFFFAOYSA-N | InChI=1S/C21H29N3O5S2/c1-7-28-19(26)15-13-9-8-12(21(3,4)5)10-14(13)31-17(15)22-16(25)11(2)30-18-20(27)29-23-24(18)6/h11-12H,7-10H2,1-6H3,(H-,22,23,25,26,27) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3C)[O-])CC(CC2)C(C)(C)C | |
| AKOS005251989 | 467.602 | C21 H29 N3 O5 S2 | RJDFGAOLXFGXHR-UHFFFAOYSA-N | InChI=1S/C21H29N3O5S2/c1-7-13(31-18-20(27)29-23-24(18)5)16(25)22-17-15(19(26)28-6)12-9-8-11(21(2,3)4)10-14(12)30-17/h11,13H,7-10H2,1-6H3,(H-,22,23,25,26,27) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C(C)(C)C)C(=O)OC)Sc3c(on[n+]3C)[O-] | |
| AKOS005252645 | 467.602 | C21 H29 N3 O5 S2 | JNXUFSIZWISURF-UHFFFAOYSA-N | InChI=1S/C21H29N3O5S2/c1-6-28-19(26)16-13-8-7-12(21(2,3)4)11-14(13)31-17(16)22-15(25)9-10-30-18-20(27)29-23-24(18)5/h12H,6-11H2,1-5H3,(H-,22,23,25,26,27) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3C)[O-])CC(CC2)C(C)(C)C | |
| AKOS005253764 | 483.327 | C22 H12 Cl2 N4 O3 S | FJATTYMELQQPBO-UHFFFAOYSA-N | InChI=1S/C22H12Cl2N4O3S/c23-11-6-7-13(15(24)10-11)16-9-8-14-17(25)20(32-21(14)26-16)19(29)18-22(30)31-27-28(18)12-4-2-1-3-5-12/h1-10H,(H2-,25,27,29,30) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4ccc(nc4s3)c5ccc(cc5Cl)Cl)N | |
| AKOS005250808 | 448.882 | C22 H13 Cl N4 O3 S | GGRMJSSIMGLHRM-UHFFFAOYSA-N | InChI=1S/C22H13ClN4O3S/c23-16-9-6-14(7-10-16)18-11-8-15(12-24)21(25-18)31-13-19(28)20-22(29)30-26-27(20)17-4-2-1-3-5-17/h1-11H,13H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(ccc(n3)c4ccc(cc4)Cl)C#N | |
| AKOS005253681 | 448.882 | C22 H13 Cl N4 O3 S | BLDUSGPMIBRTAU-UHFFFAOYSA-N | InChI=1S/C22H13ClN4O3S/c23-13-8-6-12(7-9-13)16-11-10-15-17(24)20(31-21(15)25-16)19(28)18-22(29)30-26-27(18)14-4-2-1-3-5-14/h1-11H,(H2-,24,26,28,29) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4ccc(nc4s3)c5ccc(cc5)Cl)N | |
| AKOS005253754 | 432.427 | C22 H13 F N4 O3 S | MBHDYNPVGBQWPY-UHFFFAOYSA-N | InChI=1S/C22H13FN4O3S/c23-13-8-6-12(7-9-13)16-11-10-15-17(24)20(31-21(15)25-16)19(28)18-22(29)30-26-27(18)14-4-2-1-3-5-14/h1-11H,(H2-,24,26,28,29) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4ccc(nc4s3)c5ccc(cc5)F)N | |
| AKOS005219801 | 454.358 | C22 H13 F3 N4 O4 | VCVIYPHNKDXZRU-UHFFFAOYSA-N | InChI=1S/C22H13F3N4O4/c23-22(24,25)19-16(18(30)12-7-3-1-4-8-12)15(14(11-26)20(27)32-19)17-21(31)33-28-29(17)13-9-5-2-6-10-13/h1-10,15H,27H2 | c1ccc(cc1)C(=O)C2=C(OC(=C(C2c3c(on[n+]3c4ccccc4)[O-])C#N)N)C(F)(F)F | |
| AKOS005250436 | 518.488 | C22 H13 F3 N4 O4 S2 | SPNAPTWETWJLIY-UHFFFAOYSA-N | InChI=1S/C22H13F3N4O4S2/c1-32-13-6-4-12(5-7-13)29-19(21(31)33-28-29)17(30)11-35-20-14(10-26)15(22(23,24)25)9-16(27-20)18-3-2-8-34-18/h2-9H,11H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(c(cc(n3)c4cccs4)C(F)(F)F)C#N | |
| AKOS005253728 | 518.488 | C22 H13 F3 N4 O4 S2 | BIXQKBYLFBVFAS-UHFFFAOYSA-N | InChI=1S/C22H13F3N4O4S2/c1-32-11-6-4-10(5-7-11)29-17(21(31)33-28-29)18(30)19-16(26)15-12(22(23,24)25)9-13(27-20(15)35-19)14-3-2-8-34-14/h2-9H,1H3,(H2-,26,28,30,31) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5cccs5)C(F)(F)F)N | |
| AKOS005219509 | 414.437 | C22 H14 N4 O3 S | WVTZSXAEHBVXFQ-UHFFFAOYSA-N | InChI=1S/C22H14N4O3S/c23-13-16-11-12-18(15-7-3-1-4-8-15)24-21(16)30-14-19(27)20-22(28)29-25-26(20)17-9-5-2-6-10-17/h1-12H,14H2 | c1ccc(cc1)c2ccc(c(n2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])C#N | |
| AKOS005253673 | 414.437 | C22 H14 N4 O3 S | WESJXDKSHBGKQP-UHFFFAOYSA-N | InChI=1S/C22H14N4O3S/c23-17-15-11-12-16(13-7-3-1-4-8-13)24-21(15)30-20(17)19(27)18-22(28)29-25-26(18)14-9-5-2-6-10-14/h1-12H,(H2-,23,25,27,28) | c1ccc(cc1)c2ccc3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccccc5)[O-])N | |
| AKOS005250438 | 490.514 | C22 H14 N6 O4 S2 | IOSMWCHNIAAFQS-UHFFFAOYSA-N | InChI=1S/C22H14N6O4S2/c1-31-13-6-4-12(5-7-13)28-19(22(30)32-27-28)16(29)11-34-21-15(10-24)18(17-3-2-8-33-17)14(9-23)20(25)26-21/h2-8H,11H2,1H3,(H2-,25,26,27,29,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(c(c(c(n3)N)C#N)c4cccs4)C#N | |
| AKOS005253776 | 490.514 | C22 H14 N6 O4 S2 | BKMACBVQWDLWRU-UHFFFAOYSA-N | InChI=1S/C22H14N6O4S2/c1-31-11-6-4-10(5-7-11)28-17(22(30)32-27-28)18(29)19-16(24)15-14(13-3-2-8-33-13)12(9-23)20(25)26-21(15)34-19/h2-8H,1H3,(H4-,24,25,26,27,29,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(c(c(nc4s3)N)C#N)c5cccs5)N | |
| AKOS005254190 | 490.514 | C22 H14 N6 O4 S2 | LNVNUWADPWCYAR-UHFFFAOYSA-N | InChI=1S/C22H14N6O4S2/c1-31-12-4-2-11(3-5-12)28-17(22(30)32-27-28)18(29)19-16(24)15-14(10-6-7-33-9-10)13(8-23)20(25)26-21(15)34-19/h2-7,9H,1H3,(H4-,24,25,26,27,29,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(c(c(nc4s3)N)C#N)c5ccsc5)N | |
| AKOS005250445 | 474.449 | C22 H14 N6 O5 S | XYUJUGJEYBXCKD-UHFFFAOYSA-N | InChI=1S/C22H14N6O5S/c1-31-13-6-4-12(5-7-13)28-19(22(30)33-27-28)16(29)11-34-21-15(10-24)18(17-3-2-8-32-17)14(9-23)20(25)26-21/h2-8H,11H2,1H3,(H2-,25,26,27,29,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(c(c(c(n3)N)C#N)c4ccco4)C#N | |
| AKOS005254200 | 474.449 | C22 H14 N6 O5 S | VILDXOCOGUIFBT-UHFFFAOYSA-N | InChI=1S/C22H14N6O5S/c1-31-11-6-4-10(5-7-11)28-17(22(30)33-27-28)18(29)19-16(24)15-14(13-3-2-8-32-13)12(9-23)20(25)26-21(15)34-19/h2-8H,1H3,(H4-,24,25,26,27,29,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(c(c(nc4s3)N)C#N)c5ccco5)N | |
| AKOS005250394 | 417.437 | C22 H15 N3 O4 S | MPSMKIUGXCADTO-UHFFFAOYSA-N | InChI=1S/C22H15N3O4S/c1-28-15-12-10-14(11-13-15)25-20(22(27)29-23-25)21(26)24-16-6-2-4-8-18(16)30-19-9-5-3-7-17(19)24/h2-13H,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3c4ccccc4Sc5c3cccc5 | |
| AKOS005253426 | 457.465 | C22 H15 N7 O3 S | HCKZFXZOXGMKKZ-UHFFFAOYSA-N | InChI=1S/C22H15N7O3S/c1-29-17(22(31)32-28-29)14-13(9-23)19(25)27-21-15(14)16(24)18(33-21)20(30)26-12-7-6-10-4-2-3-5-11(10)8-12/h2-8H,1H3,(H5-,24,25,26,27,28,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc5ccccc5c4)N)N)C#N | |
| AKOS005253529 | 457.465 | C22 H15 N7 O3 S | ZMDWJNBIUVOGAJ-UHFFFAOYSA-N | InChI=1S/C22H15N7O3S/c1-29-17(22(31)32-28-29)14-12(9-23)19(25)27-21-15(14)16(24)18(33-21)20(30)26-13-8-4-6-10-5-2-3-7-11(10)13/h2-8H,1H3,(H5-,24,25,26,27,28,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4cccc5c4cccc5)N)N)C#N | |
| AKOS005253552 | 457.465 | C22 H15 N7 O3 S | VCHQHGDSBFOONN-UHFFFAOYSA-N | InChI=1S/C22H15N7O3S/c1-29-19(22(31)32-28-29)18-15(9-23)20(25)27-21(16(18)10-24)33-11-17(30)26-14-7-6-12-4-2-3-5-13(12)8-14/h2-8H,11H2,1H3,(H3-,25,26,27,28,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc4ccccc4c3)N)C#N | |
| AKOS005253553 | 457.465 | C22 H15 N7 O3 S | KWOJLVDAIWQQLN-UHFFFAOYSA-N | InChI=1S/C22H15N7O3S/c1-29-19(22(31)32-28-29)18-14(9-23)20(25)27-21(15(18)10-24)33-11-17(30)26-16-8-4-6-12-5-2-3-7-13(12)16/h2-8H,11H2,1H3,(H3-,25,26,27,28,30,31) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3cccc4c3cccc4)N)C#N | |
| AKOS005250745 | 464.451 | C22 H16 N4 O6 S | JTRLSWDNXJHAPO-OQLLNIDSSA-N | InChI=1S/C22H16N4O6S/c1-25-19(21(29)32-24-25)16(27)11-33-22-23-15(20(28)26(22)14-5-3-2-4-6-14)9-13-7-8-17-18(10-13)31-12-30-17/h2-10H,11-12H2,1H3/b15-9+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3ccc4c(c3)OCO4)/C(=O)N2c5ccccc5 | |
| AKOS005219471 | 412.401 | C22 H16 N6 O3 | HHWYXFNKQIXBII-UHFFFAOYSA-N | InChI=1S/C22H16N6O3/c1-13-17-18(19-22(29)31-26-27(19)14-8-4-2-5-9-14)16(12-23)20(24)30-21(17)28(25-13)15-10-6-3-7-11-15/h2-11,18H,24H2,1H3 | Cc1c2c(n(n1)c3ccccc3)OC(=C(C2c4c(on[n+]4c5ccccc5)[O-])C#N)N | |
| AKOS005253219 | 472.479 | C22 H16 N8 O3 S | YRLHDVTYDQEPFE-UHFFFAOYSA-N | InChI=1S/C22H16N8O3S/c1-11(20(31)27-16-7-3-6-15-12(16)5-4-8-26-15)34-21-14(10-24)17(13(9-23)19(25)28-21)18-22(32)33-29-30(18)2/h3-8,11H,1-2H3,(H3-,25,26,27,28,29,31,32) | CC(C(=O)Nc1cccc2c1cccn2)Sc3c(c(c(c(n3)N)C#N)c4c(on[n+]4C)[O-])C#N | |
| AKOS005252910 | 485.918 | C22 H17 Cl F N5 O3 S | KUNGZBPYZNIFRX-WQRHYEAKSA-N | InChI=1S/C22H17ClFN5O3S/c1-2-28-12-20(32-27-28)26-19(30)13-33-22-25-18(11-15-16(23)9-6-10-17(15)24)21(31)29(22)14-7-4-3-5-8-14/h3-12H,2,13H2,1H3/b18-11- | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C\c3c(cccc3Cl)F)/C(=O)N2c4ccccc4 | |
| AKOS005252800 | 502.373 | C22 H17 Cl2 N5 O3 S | MRRDJBTXLULVSL-GZTJUZNOSA-N | InChI=1S/C22H17Cl2N5O3S/c1-2-28-12-19(32-27-28)26-18(30)13-33-22-25-17(11-14-7-6-10-16(23)20(14)24)21(31)29(22)15-8-4-3-5-9-15/h3-12H,2,13H2,1H3/b17-11+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252801 | 502.373 | C22 H17 Cl2 N5 O3 S | MRFPRKYLBNRWBB-VCHYOVAHSA-N | InChI=1S/C22H17Cl2N5O3S/c1-2-28-12-20(32-27-28)26-19(30)13-33-22-25-18(10-14-8-9-15(23)11-17(14)24)21(31)29(22)16-6-4-3-5-7-16/h3-12H,2,13H2,1H3/b18-10+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252911 | 502.373 | C22 H17 Cl2 N5 O3 S | YNNVMIVWKVKVNV-WQRHYEAKSA-N | InChI=1S/C22H17Cl2N5O3S/c1-2-28-12-20(32-27-28)26-19(30)13-33-22-25-18(11-15-16(23)9-6-10-17(15)24)21(31)29(22)14-7-4-3-5-8-14/h3-12H,2,13H2,1H3/b18-11- | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C\c3c(cccc3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005251162 | 419.453 | C22 H17 N3 O4 S | CTLBNLIWPSSGDQ-UHFFFAOYSA-N | InChI=1S/C22H17N3O4S/c26-20(15-30-21-22(27)29-24-25(21)17-7-3-1-4-8-17)23-16-11-13-19(14-12-16)28-18-9-5-2-6-10-18/h1-14H,15H2,(H-,23,24,26,27) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)Oc4ccccc4 | |
| AKOS005250152 | 403.387 | C22 H17 N3 O5 | BEAZNOBKUFNBEO-UHFFFAOYSA-N | InChI=1S/C22H17N3O5/c1-28-17-13-9-16(10-14-17)25-20(22(27)30-24-25)21(26)23-15-7-11-19(12-8-15)29-18-5-3-2-4-6-18/h2-14H,1H3,(H-,23,24,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(cc3)Oc4ccccc4 | |
| AKOS005252494 | 463.466 | C22 H17 N5 O5 S | GKRHHYGJBRCTGZ-CXUHLZMHSA-N | InChI=1S/C22H17N5O5S/c1-26-11-20(32-25-26)24-19(28)12-33-22-23-16(21(29)27(22)15-5-3-2-4-6-15)9-14-7-8-17-18(10-14)31-13-30-17/h2-11H,12-13H2,1H3/b16-9+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc4c(c3)OCO4)/C(=O)N2c5ccccc5 | |
| AKOS005252817 | 512.379 | C22 H18 Br N5 O3 S | CQJPQDODCPQSLB-LDADJPATSA-N | InChI=1S/C22H18BrN5O3S/c1-2-27-13-20(31-26-27)25-19(29)14-32-22-24-18(12-15-7-6-8-16(23)11-15)21(30)28(22)17-9-4-3-5-10-17/h3-13H,2,14H2,1H3/b18-12+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3)Br)/C(=O)N2c4ccccc4 | |
| AKOS005252818 | 512.379 | C22 H18 Br N5 O3 S | IFRASYJBLDWECR-LDADJPATSA-N | InChI=1S/C22H18BrN5O3S/c1-2-27-13-20(31-26-27)25-19(29)14-32-22-24-18(12-15-8-10-16(23)11-9-15)21(30)28(22)17-6-4-3-5-7-17/h3-13H,2,14H2,1H3/b18-12+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)Br)/C(=O)N2c4ccccc4 | |
| AKOS005252771 | 500.933 | C22 H18 Cl F N6 O3 S | AOBOJXUZXYXSPQ-WQRHYEAKSA-N | InChI=1S/C22H18ClFN6O3S/c1-28(2)29-12-20(33-27-29)26-19(31)13-34-22-25-18(11-15-16(23)9-6-10-17(15)24)21(32)30(22)14-7-4-3-5-8-14/h3-12H,13H2,1-2H3/b18-11- | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C\c3c(cccc3Cl)F)/C(=O)N2c4ccccc4 | |
| AKOS005252917 | 467.928 | C22 H18 Cl N5 O3 S | VLEJCKOOFMBYSZ-LDADJPATSA-N | InChI=1S/C22H18ClN5O3S/c1-2-27-13-20(31-26-27)25-19(29)14-32-22-24-18(12-15-8-6-7-11-17(15)23)21(30)28(22)16-9-4-3-5-10-16/h3-13H,2,14H2,1H3/b18-12+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252918 | 467.928 | C22 H18 Cl N5 O3 S | QKHKOIUOGUUEGO-LDADJPATSA-N | InChI=1S/C22H18ClN5O3S/c1-2-27-13-20(31-26-27)25-19(29)14-32-22-24-18(12-15-7-6-8-16(23)11-15)21(30)28(22)17-9-4-3-5-10-17/h3-13H,2,14H2,1H3/b18-12+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252925 | 467.928 | C22 H18 Cl N5 O3 S | NEYXBVXYSBSCQW-LDADJPATSA-N | InChI=1S/C22H18ClN5O3S/c1-2-27-13-20(31-26-27)25-19(29)14-32-22-24-18(12-15-8-10-16(23)11-9-15)21(30)28(22)17-6-4-3-5-7-17/h3-13H,2,14H2,1H3/b18-12+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252717 | 517.388 | C22 H18 Cl2 N6 O3 S | ASCVEXLMUXQPOJ-GZTJUZNOSA-N | InChI=1S/C22H18Cl2N6O3S/c1-28(2)29-12-19(33-27-29)26-18(31)13-34-22-25-17(11-14-7-6-10-16(23)20(14)24)21(32)30(22)15-8-4-3-5-9-15/h3-12H,13H2,1-2H3/b17-11+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252718 | 517.388 | C22 H18 Cl2 N6 O3 S | HIBKUYMLBBWYLK-VCHYOVAHSA-N | InChI=1S/C22H18Cl2N6O3S/c1-28(2)29-12-20(33-27-29)26-19(31)13-34-22-25-18(10-14-8-9-15(23)11-17(14)24)21(32)30(22)16-6-4-3-5-7-16/h3-12H,13H2,1-2H3/b18-10+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252725 | 517.388 | C22 H18 Cl2 N6 O3 S | LNNJJJVROKVRRY-WQRHYEAKSA-N | InChI=1S/C22H18Cl2N6O3S/c1-28(2)29-12-20(33-27-29)26-19(31)13-34-22-25-18(11-15-16(23)9-6-10-17(15)24)21(32)30(22)14-7-4-3-5-8-14/h3-12H,13H2,1-2H3/b18-11- | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C\c3c(cccc3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252922 | 451.473 | C22 H18 F N5 O3 S | BXWHSILKEDAINK-LDADJPATSA-N | InChI=1S/C22H18FN5O3S/c1-2-27-13-20(31-26-27)25-19(29)14-32-22-24-18(12-15-8-6-7-11-17(15)23)21(30)28(22)16-9-4-3-5-10-16/h3-13H,2,14H2,1H3/b18-12+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3F)/C(=O)N2c4ccccc4 | |
| AKOS005252929 | 451.473 | C22 H18 F N5 O3 S | OKDXXCXUUNANLR-LDADJPATSA-N | InChI=1S/C22H18FN5O3S/c1-2-27-13-20(31-26-27)25-19(29)14-32-22-24-18(12-15-8-10-16(23)11-9-15)21(30)28(22)17-6-4-3-5-7-17/h3-13H,2,14H2,1H3/b18-12+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)F)/C(=O)N2c4ccccc4 | |
| AKOS005253918 | 521.469 | C22 H18 F3 N5 O5 S | FQJQBXBWCFLVHM-UHFFFAOYSA-N | InChI=1S/C22H18F3N5O5S/c1-28-17(20(33)35-27-28)12-29-16(19(32)30(21(29)36)14-5-3-2-4-6-14)11-18(31)26-13-7-9-15(10-8-13)34-22(23,24)25/h2-10,16H,11-12H2,1H3,(H-,26,27,31,33) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)c3ccccc3)CC(=O)Nc4ccc(cc4)OC(F)(F)F | |
| AKOS005250699 | 434.468 | C22 H18 N4 O4 S | ISCWROKCVSGGPJ-SFQUDFHCSA-N | InChI=1S/C22H18N4O4S/c1-14-7-6-8-15(11-14)12-17-20(28)26(16-9-4-3-5-10-16)22(23-17)31-13-18(27)19-21(29)30-24-25(19)2/h3-12H,13H2,1-2H3/b17-12+ | Cc1cccc(c1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3C)[O-])c4ccccc4 | |
| AKOS005250700 | 434.468 | C22 H18 N4 O4 S | XCEMRZOZTYNMDZ-SFQUDFHCSA-N | InChI=1S/C22H18N4O4S/c1-14-8-10-15(11-9-14)12-17-20(28)26(16-6-4-3-5-7-16)22(23-17)31-13-18(27)19-21(29)30-24-25(19)2/h3-12H,13H2,1-2H3/b17-12+ | Cc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3C)[O-])c4ccccc4 | |
| AKOS005250739 | 434.468 | C22 H18 N4 O4 S | UYNJHMMSLDLXMN-SFQUDFHCSA-N | InChI=1S/C22H18N4O4S/c1-14-8-6-7-9-15(14)12-17-20(28)26(16-10-4-3-5-11-16)22(23-17)31-13-18(27)19-21(29)30-24-25(19)2/h3-12H,13H2,1-2H3/b17-12+ | Cc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3C)[O-])c4ccccc4 | |
| AKOS005250708 | 450.467 | C22 H18 N4 O5 S | DQYKRTWHOYVTGG-SFQUDFHCSA-N | InChI=1S/C22H18N4O5S/c1-25-19(21(29)31-24-25)18(27)13-32-22-23-17(12-14-8-10-16(30-2)11-9-14)20(28)26(22)15-6-4-3-5-7-15/h3-12H,13H2,1-2H3/b17-12+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3ccc(cc3)OC)/C(=O)N2c4ccccc4 | |
| AKOS005250709 | 450.467 | C22 H18 N4 O5 S | ITXDVRSDWCCDMI-FOWTUZBSSA-N | InChI=1S/C22H18N4O5S/c1-25-19(21(29)31-24-25)17(27)13-32-22-23-16(12-14-8-6-7-11-18(14)30-2)20(28)26(22)15-9-4-3-5-10-15/h3-12H,13H2,1-2H3/b16-12+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3ccccc3OC)/C(=O)N2c4ccccc4 | |
| AKOS005250731 | 450.467 | C22 H18 N4 O5 S | MSFSEQCQZZPTMU-SFQUDFHCSA-N | InChI=1S/C22H18N4O5S/c1-25-19(21(29)31-24-25)18(27)13-32-22-23-17(12-14-7-6-10-16(11-14)30-2)20(28)26(22)15-8-4-3-5-9-15/h3-12H,13H2,1-2H3/b17-12+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3cccc(c3)OC)/C(=O)N2c4ccccc4 | |
| AKOS005250779 | 450.467 | C22 H18 N4 O5 S | IAMOAZANZXYCDX-UHFFFAOYSA-N | InChI=1S/C22H18N4O5S/c1-30-15-10-8-14(9-11-15)26-19(21(29)31-24-26)18(27)12-32-22-23-17-5-3-2-4-16(17)20(28)25(22)13-6-7-13/h2-5,8-11,13H,6-7,12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nc4ccccc4c(=O)n3C5CC5 | |
| AKOS005251252 | 483.315 | C22 H19 Br N4 O4 | UCVKHKWPZXQADS-UHFFFAOYSA-N | InChI=1S/C22H19BrN4O4/c23-14-6-8-16(9-7-14)26-20(28)12-18(21(26)29)25(15-10-11-15)13-19-22(30)31-24-27(19)17-4-2-1-3-5-17/h1-9,15,18H,10-13H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C4CC(=O)N(C4=O)c5ccc(cc5)Br | |
| AKOS005252711 | 527.394 | C22 H19 Br N6 O3 S | SBWDVMXTYYLAFT-LDADJPATSA-N | InChI=1S/C22H19BrN6O3S/c1-27(2)28-13-20(32-26-28)25-19(30)14-33-22-24-18(12-15-8-10-16(23)11-9-15)21(31)29(22)17-6-4-3-5-7-17/h3-13H,14H2,1-2H3/b18-12+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)Br)/C(=O)N2c4ccccc4 | |
| AKOS005252751 | 527.394 | C22 H19 Br N6 O3 S | DPFWPIFOXPNFKF-LDADJPATSA-N | InChI=1S/C22H19BrN6O3S/c1-27(2)28-13-20(32-26-28)25-19(30)14-33-22-24-18(12-15-7-6-8-16(23)11-15)21(31)29(22)17-9-4-3-5-10-17/h3-13H,14H2,1-2H3/b18-12+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3)Br)/C(=O)N2c4ccccc4 | |
| AKOS005251376 | 438.864 | C22 H19 Cl N4 O4 | MDQUMUAPYUFQGA-UHFFFAOYSA-N | InChI=1S/C22H19ClN4O4/c23-14-6-8-16(9-7-14)26-20(28)12-18(21(26)29)25(15-10-11-15)13-19-22(30)31-24-27(19)17-4-2-1-3-5-17/h1-9,15,18H,10-13H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C4CC(=O)N(C4=O)c5ccc(cc5)Cl | |
| AKOS005252701 | 482.943 | C22 H19 Cl N6 O3 S | GLHDTKCPTWSFHN-LDADJPATSA-N | InChI=1S/C22H19ClN6O3S/c1-27(2)28-13-20(32-26-28)25-19(30)14-33-22-24-18(12-15-8-6-7-11-17(15)23)21(31)29(22)16-9-4-3-5-10-16/h3-13H,14H2,1-2H3/b18-12+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252702 | 482.943 | C22 H19 Cl N6 O3 S | HSGVOMAQADTTBJ-LDADJPATSA-N | InChI=1S/C22H19ClN6O3S/c1-27(2)28-13-20(32-26-28)25-19(30)14-33-22-24-18(12-15-7-6-8-16(23)11-15)21(31)29(22)17-9-4-3-5-10-17/h3-13H,14H2,1-2H3/b18-12+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252709 | 482.943 | C22 H19 Cl N6 O3 S | LZKBARQGOPNNAP-LDADJPATSA-N | InChI=1S/C22H19ClN6O3S/c1-27(2)28-13-20(32-26-28)25-19(30)14-33-22-24-18(12-15-8-10-16(23)11-9-15)21(31)29(22)17-6-4-3-5-7-17/h3-13H,14H2,1-2H3/b18-12+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005251377 | 422.409 | C22 H19 F N4 O4 | SFFQHQJCWIEIPJ-UHFFFAOYSA-N | InChI=1S/C22H19FN4O4/c23-14-6-8-16(9-7-14)26-20(28)12-18(21(26)29)25(15-10-11-15)13-19-22(30)31-24-27(19)17-4-2-1-3-5-17/h1-9,15,18H,10-13H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C4CC(=O)N(C4=O)c5ccc(cc5)F | |
| AKOS005252695 | 466.488 | C22 H19 F N6 O3 S | LTRMDFVYQABGEL-LDADJPATSA-N | InChI=1S/C22H19FN6O3S/c1-27(2)28-13-20(32-26-28)25-19(30)14-33-22-24-18(12-15-8-10-16(23)11-9-15)21(31)29(22)17-6-4-3-5-7-17/h3-13H,14H2,1-2H3/b18-12+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)F)/C(=O)N2c4ccccc4 | |
| AKOS005252764 | 466.488 | C22 H19 F N6 O3 S | FXEJHSVVGHAXSQ-LDADJPATSA-N | InChI=1S/C22H19FN6O3S/c1-27(2)28-13-20(32-26-28)25-19(30)14-33-22-24-18(12-15-8-6-7-11-17(15)23)21(31)29(22)16-9-4-3-5-10-16/h3-13H,14H2,1-2H3/b18-12+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3F)/C(=O)N2c4ccccc4 | |
| AKOS005253596 | 492.405 | C22 H19 F3 N4 O6 | XBFREZKCBRTJJR-UHFFFAOYSA-N | InChI=1S/C22H19F3N4O6/c23-22(24,25)34-16-8-6-14(7-9-16)26-19(30)12-18-20(31)28(10-11-33-18)13-17-21(32)35-27-29(17)15-4-2-1-3-5-15/h1-9,18H,10-13H2,(H-,26,27,30,32) | c1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)OC(F)(F)F | |
| AKOS005253063 | 488.485 | C22 H19 F3 N6 O2 S | BLUJEIVKNWTBTP-UHFFFAOYSA-N | InChI=1S/C22H19F3N6O2S/c23-22(24,25)17-11-18(15-7-3-1-4-8-15)27-21(16(17)12-26)34-14-19(32)28-20-13-31(29-33-20)30-9-5-2-6-10-30/h1,3-4,7-8,11,13H,2,5-6,9-10,14H2 | c1ccc(cc1)c2cc(c(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)C#N)C(F)(F)F | |
| AKOS005253018 | 520.484 | C22 H19 F3 N6 O4 S | IUPXUHZJTCHTSP-UHFFFAOYSA-N | InChI=1S/C22H19F3N6O4S/c1-33-15-4-2-14(3-5-15)18-10-17(22(23,24)25)16(11-26)21(27-18)36-13-19(32)28-20-12-31(29-35-20)30-6-8-34-9-7-30/h2-5,10,12H,6-9,13H2,1H3 | COc1ccc(cc1)c2cc(c(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)C#N)C(F)(F)F | |
| AKOS005252099 | 405.47 | C22 H19 N3 O3 S | CLPICTCFTCKVMF-UHFFFAOYSA-N | InChI=1S/C22H19N3O3S/c1-2-19(20(26)23-17-13-12-15-8-6-7-9-16(15)14-17)29-21-22(27)28-24-25(21)18-10-4-3-5-11-18/h3-14,19H,2H2,1H3,(H-,23,24,26,27) | CCC(C(=O)Nc1ccc2ccccc2c1)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252108 | 405.47 | C22 H19 N3 O3 S | PRYUOPFAXPLXJU-UHFFFAOYSA-N | InChI=1S/C22H19N3O3S/c1-2-19(20(26)23-18-14-8-10-15-9-6-7-13-17(15)18)29-21-22(27)28-24-25(21)16-11-4-3-5-12-16/h3-14,19H,2H2,1H3,(H-,23,24,26,27) | CCC(C(=O)Nc1cccc2c1cccc2)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250334 | 389.404 | C22 H19 N3 O4 | CHCUHXCYUVDYJU-UHFFFAOYSA-N | InChI=1S/C22H19N3O4/c1-24(21(26)17-8-7-15-5-3-4-6-16(15)13-17)14-20-22(27)29-23-25(20)18-9-11-19(28-2)12-10-18/h3-13H,14H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)c3ccc4ccccc4c3 | |
| AKOS005251804 | 421.469 | C22 H19 N3 O4 S | YMIYMUJEAVGGNM-UHFFFAOYSA-N | InChI=1S/C22H19N3O4S/c1-14(20(26)23-17-8-7-15-5-3-4-6-16(15)13-17)30-21-22(27)29-24-25(21)18-9-11-19(28-2)12-10-18/h3-14H,1-2H3,(H-,23,24,26,27) | CC(C(=O)Nc1ccc2ccccc2c1)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005251805 | 421.469 | C22 H19 N3 O4 S | KPDYUAJKOJHXOY-UHFFFAOYSA-N | InChI=1S/C22H19N3O4S/c1-14(20(26)23-19-9-5-7-15-6-3-4-8-18(15)19)30-21-22(27)29-24-25(21)16-10-12-17(28-2)13-11-16/h3-14H,1-2H3,(H-,23,24,26,27) | CC(C(=O)Nc1cccc2c1cccc2)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252241 | 421.469 | C22 H19 N3 O4 S | YFFZTTLNIMDUFT-UHFFFAOYSA-N | InChI=1S/C22H19N3O4S/c1-28-19-10-8-18(9-11-19)25-21(22(27)29-24-25)30-13-12-20(26)23-17-7-6-15-4-2-3-5-16(15)14-17/h2-11,14H,12-13H2,1H3,(H-,23,24,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc4ccccc4c3 | |
| AKOS005252242 | 421.469 | C22 H19 N3 O4 S | OQDNEISYGMZTOB-UHFFFAOYSA-N | InChI=1S/C22H19N3O4S/c1-28-17-11-9-16(10-12-17)25-21(22(27)29-24-25)30-14-13-20(26)23-19-8-4-6-15-5-2-3-7-18(15)19/h2-12H,13-14H2,1H3,(H-,23,24,26,27) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3cccc4c3cccc4 | |
| AKOS005252433 | 433.483 | C22 H19 N5 O3 S | ZKGAOUBOFTVILO-LDADJPATSA-N | InChI=1S/C22H19N5O3S/c1-15-7-6-8-16(11-15)12-18-21(29)27(17-9-4-3-5-10-17)22(23-18)31-14-19(28)24-20-13-26(2)25-30-20/h3-13H,14H2,1-2H3/b18-12+ | Cc1cccc(c1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)C)c4ccccc4 | |
| AKOS005252434 | 433.483 | C22 H19 N5 O3 S | RCOKDBMXROGDKD-LDADJPATSA-N | InChI=1S/C22H19N5O3S/c1-15-8-10-16(11-9-15)12-18-21(29)27(17-6-4-3-5-7-17)22(23-18)31-14-19(28)24-20-13-26(2)25-30-20/h3-13H,14H2,1-2H3/b18-12+ | Cc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)C)c4ccccc4 | |
| AKOS005252511 | 433.483 | C22 H19 N5 O3 S | SESLHEDEDMQAOE-LDADJPATSA-N | InChI=1S/C22H19N5O3S/c1-15-8-6-7-9-16(15)12-18-21(29)27(17-10-4-3-5-11-17)22(23-18)31-14-19(28)24-20-13-26(2)25-30-20/h3-13H,14H2,1-2H3/b18-12+ | Cc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)C)c4ccccc4 | |
| AKOS005252819 | 433.483 | C22 H19 N5 O3 S | FDHLQVCEJBNPOF-QGOAFFKASA-N | InChI=1S/C22H19N5O3S/c1-2-26-14-20(30-25-26)24-19(28)15-31-22-23-18(13-16-9-5-3-6-10-16)21(29)27(22)17-11-7-4-8-12-17/h3-14H,2,15H2,1H3/b18-13+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3)/C(=O)N2c4ccccc4 | |
| AKOS005252449 | 449.482 | C22 H19 N5 O4 S | JRKWSHUJYGLHOW-LDADJPATSA-N | InChI=1S/C22H19N5O4S/c1-26-13-20(31-25-26)24-19(28)14-32-22-23-18(12-15-8-10-17(30-2)11-9-15)21(29)27(22)16-6-4-3-5-7-16/h3-13H,14H2,1-2H3/b18-12+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252450 | 449.482 | C22 H19 N5 O4 S | ZWBNKXHJGOOMAH-SFQUDFHCSA-N | InChI=1S/C22H19N5O4S/c1-26-13-20(31-25-26)24-19(28)14-32-22-23-17(12-15-8-6-7-11-18(15)30-2)21(29)27(22)16-9-4-3-5-10-16/h3-13H,14H2,1-2H3/b17-12+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3OC)/C(=O)N2c4ccccc4 | |
| AKOS005252458 | 449.482 | C22 H19 N5 O4 S | JMVWEIOWHFLCCR-LDADJPATSA-N | InChI=1S/C22H19N5O4S/c1-26-13-20(31-25-26)24-19(28)14-32-22-23-18(12-15-7-6-10-17(11-15)30-2)21(29)27(22)16-8-4-3-5-9-16/h3-13H,14H2,1-2H3/b18-12+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253264 | 449.482 | C22 H19 N5 O4 S | ADQWYDXKVRCALJ-UHFFFAOYSA-N | InChI=1S/C22H19N5O4S/c1-12-3-8-15-18(9-12)32-20(24-15)13-4-6-14(7-5-13)27-19(28)10-16(21(27)29)23-11-17-22(30)31-25-26(17)2/h3-9,16,23H,10-11H2,1-2H3 | Cc1ccc2c(c1)sc(n2)c3ccc(cc3)N4C(=O)CC(C4=O)NCc5c(on[n+]5C)[O-] | |
| AKOS005251297 | 433.417 | C22 H19 N5 O5 | ACFUFACSQCEETP-UHFFFAOYSA-N | InChI=1S/C22H19N5O5/c1-25(12-17-22(30)32-24-26(17)2)16-11-19(28)27(21(16)29)14-9-7-13(8-10-14)20-23-15-5-3-4-6-18(15)31-20/h3-10,16H,11-12H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C2CC(=O)N(C2=O)c3ccc(cc3)c4nc5ccccc5o4 | |
| AKOS005251254 | 449.416 | C22 H19 N5 O6 | LDUYWZCGBBTECV-UHFFFAOYSA-N | InChI=1S/C22H19N5O6/c28-20-12-18(21(29)25(20)15-8-10-17(11-9-15)27(31)32)24(14-6-7-14)13-19-22(30)33-23-26(19)16-4-2-1-3-5-16/h1-5,8-11,14,18H,6-7,12-13H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C4CC(=O)N(C4=O)c5ccc(cc5)[N+](=O)[O-] | |
| AKOS005253053 | 445.497 | C22 H19 N7 O2 S | KUVIZHYLDFRCSM-UHFFFAOYSA-N | InChI=1S/C22H19N7O2S/c30-17(23-18-12-29(27-31-18)28-10-2-1-3-11-28)13-32-22-24-20-15-8-4-6-14-7-5-9-16(19(14)15)21(20)25-26-22/h4-9,12H,1-3,10-11,13H2 | c1cc2cccc-3c2c(c1)-c4c3nnc(n4)SCC(=O)[N-]c5c[n+](no5)N6CCCCC6 | |
| AKOS005253223 | 493.495 | C22 H19 N7 O5 S | OMEJEGNLWVGAJW-UHFFFAOYSA-N | InChI=1S/C22H19N7O5S/c1-4-33-21(31)12-5-7-13(8-6-12)26-19(30)11(2)35-20-15(10-24)16(14(9-23)18(25)27-20)17-22(32)34-28-29(17)3/h5-8,11H,4H2,1-3H3,(H3-,25,26,27,28,30,31,32) | CCOC(=O)c1ccc(cc1)NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253842 | 530.394 | C22 H20 Br N5 O4 S | GJHVECVUXRRWHE-UHFFFAOYSA-N | InChI=1S/C22H20BrN5O4S/c1-13-3-9-16(10-4-13)28-20(30)17(11-19(29)24-15-7-5-14(23)6-8-15)27(22(28)33)12-18-21(31)32-25-26(18)2/h3-10,17H,11-12H2,1-2H3,(H-,24,25,29,31) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)Br | |
| AKOS005253841 | 485.943 | C22 H20 Cl N5 O4 S | JKIOHUWUPSVTLK-UHFFFAOYSA-N | InChI=1S/C22H20ClN5O4S/c1-13-3-9-16(10-4-13)28-20(30)17(11-19(29)24-15-7-5-14(23)6-8-15)27(22(28)33)12-18-21(31)32-25-26(18)2/h3-10,17H,11-12H2,1-2H3,(H-,24,25,29,31) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)Cl | |
| AKOS005253837 | 469.489 | C22 H20 F N5 O4 S | NKYBFUSRCYDBRR-UHFFFAOYSA-N | InChI=1S/C22H20FN5O4S/c1-13-3-9-16(10-4-13)28-20(30)17(11-19(29)24-15-7-5-14(23)6-8-15)27(22(28)33)12-18-21(31)32-25-26(18)2/h3-10,17H,11-12H2,1-2H3,(H-,24,25,29,31) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)F | |
| AKOS005253836 | 577.395 | C22 H20 I N5 O4 S | ZGKWMOKMDUYEJX-UHFFFAOYSA-N | InChI=1S/C22H20IN5O4S/c1-13-3-9-16(10-4-13)28-20(30)17(11-19(29)24-15-7-5-14(23)6-8-15)27(22(28)33)12-18-21(31)32-25-26(18)2/h3-10,17H,11-12H2,1-2H3,(H-,24,25,29,31) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)I | |
| AKOS005219514 | 420.484 | C22 H20 N4 O3 S | XSFNGNYRUYJDAS-UHFFFAOYSA-N | InChI=1S/C22H20N4O3S/c23-13-16-12-15-8-4-1-2-7-11-18(15)24-21(16)30-14-19(27)20-22(28)29-25-26(20)17-9-5-3-6-10-17/h3,5-6,9-10,12H,1-2,4,7-8,11,14H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(cc4c(n3)CCCCCC4)C#N | |
| AKOS005253676 | 420.484 | C22 H20 N4 O3 S | VOLRCROEOLMKSY-UHFFFAOYSA-N | InChI=1S/C22H20N4O3S/c23-17-15-12-13-8-4-1-2-7-11-16(13)24-21(15)30-20(17)19(27)18-22(28)29-25-26(18)14-9-5-3-6-10-14/h3,5-6,9-10,12H,1-2,4,7-8,11H2,(H2-,23,25,27,28) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4cc5c(nc4s3)CCCCCC5)N | |
| AKOS005250942 | 404.419 | C22 H20 N4 O4 | RYIYQGXFJCHDSR-UHFFFAOYSA-O | InChI=1S/C22H19N4O4/c1-25-19(22(29)30-24-25)13-18(23-20(27)16-8-3-2-4-9-16)21(28)26-12-11-15-7-5-6-10-17(15)14-26/h2-10,13H,11-12,14H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCc3ccccc3C2)\NC(=O)c4ccccc4 | |
| AKOS005251051 | 404.419 | C22 H20 N4 O4 | FJUXGIFUFAIBPK-UHFFFAOYSA-O | InChI=1S/C22H19N4O4/c27-20(16-9-3-1-4-10-16)23-18(21(28)25-13-7-8-14-25)15-19-22(29)30-24-26(19)17-11-5-2-6-12-17/h1-6,9-12,15H,7-8,13-14H2/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CCCC4 | |
| AKOS005251368 | 404.419 | C22 H20 N4 O4 | PCHVVMUCHKXJNA-UHFFFAOYSA-N | InChI=1S/C22H20N4O4/c27-20-13-18(21(28)25(20)16-7-3-1-4-8-16)24(15-11-12-15)14-19-22(29)30-23-26(19)17-9-5-2-6-10-17/h1-10,15,18H,11-14H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C4CC(=O)N(C4=O)c5ccccc5 | |
| AKOS005253331 | 404.419 | C22 H20 N4 O4 | FSRKEQRKEKFWSM-BQYQJAHWSA-N | InChI=1S/C22H20N4O4/c1-25-19(22(29)30-24-25)14-23-18-13-20(27)26(21(18)28)17-11-9-16(10-12-17)8-7-15-5-3-2-4-6-15/h2-12,18,23H,13-14H2,1H3/b8-7+ | C[n+]1c(c(on1)[O-])CNC2CC(=O)N(C2=O)c3ccc(cc3)/C=C/c4ccccc4 | |
| AKOS005250462 | 436.484 | C22 H20 N4 O4 S | UEELBCBEAKFLOA-UHFFFAOYSA-N | InChI=1S/C22H20N4O4S/c1-29-17-9-7-16(8-10-17)26-20(22(28)30-25-26)19(27)13-31-21-15(12-23)11-14-5-3-2-4-6-18(14)24-21/h7-11H,2-6,13H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(cc4c(n3)CCCCC4)C#N | |
| AKOS005250469 | 436.484 | C22 H20 N4 O4 S | OPVRXZWTHBUHAP-UHFFFAOYSA-N | InChI=1S/C22H20N4O4S/c1-13-3-8-18-14(9-13)10-15(11-23)21(24-18)31-12-19(27)20-22(28)30-25-26(20)16-4-6-17(29-2)7-5-16/h4-7,10,13H,3,8-9,12H2,1-2H3 | CC1CCc2c(cc(c(n2)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])C#N)C1 | |
| AKOS005251042 | 436.484 | C22 H20 N4 O4 S | FAGXDJNLSVWCNP-UHFFFAOYSA-O | InChI=1S/C22H19N4O4S/c27-20(16-7-3-1-4-8-16)23-18(21(28)25-11-13-31-14-12-25)15-19-22(29)30-24-26(19)17-9-5-2-6-10-17/h1-10,15H,11-14H2/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CCSCC4 | |
| AKOS005251973 | 436.484 | C22 H20 N4 O4 S | VNOMEBLHOWTOOK-UHFFFAOYSA-N | InChI=1S/C22H20N4O4S/c1-3-19(20(27)24-18-8-4-7-17-16(18)6-5-13-23-17)31-21-22(28)30-25-26(21)14-9-11-15(29-2)12-10-14/h4-13,19H,3H2,1-2H3,(H-,23,24,25,27,28) | CCC(C(=O)Nc1cccc2c1cccn2)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005253714 | 436.484 | C22 H20 N4 O4 S | IRVRFYLRWBKWNU-UHFFFAOYSA-N | InChI=1S/C22H20N4O4S/c1-11-3-8-16-12(9-11)10-15-17(23)20(31-21(15)24-16)19(27)18-22(28)30-25-26(18)13-4-6-14(29-2)7-5-13/h4-7,10-11H,3,8-9H2,1-2H3,(H2-,23,25,27,28) | CC1CCc2c(cc3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N)C1 | |
| AKOS005253747 | 436.484 | C22 H20 N4 O4 S | HSYSSICMMMBBPT-UHFFFAOYSA-N | InChI=1S/C22H20N4O4S/c1-29-14-9-7-13(8-10-14)26-18(22(28)30-25-26)19(27)20-17(23)15-11-12-5-3-2-4-6-16(12)24-21(15)31-20/h7-11H,2-6H2,1H3,(H2-,23,25,27,28) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4cc5c(nc4s3)CCCCC5)N | |
| AKOS005253864 | 436.484 | C22 H20 N4 O4 S | OZZJZRFALRRZGH-UHFFFAOYSA-N | InChI=1S/C22H20N4O4S/c1-5-12-6-8-13(9-7-12)15-14(11(3)27)10(2)24-21-16(15)17(23)20(31-21)19(28)18-22(29)30-25-26(18)4/h6-9H,5H2,1-4H3,(H2-,23,25,28,29) | CCc1ccc(cc1)c2c3c(c(sc3nc(c2C(=O)C)C)C(=O)c4c(on[n+]4C)[O-])N | |
| AKOS005251070 | 420.418 | C22 H20 N4 O5 | YLUKWJUOMZVJBW-UHFFFAOYSA-O | InChI=1S/C22H19N4O5/c27-20(16-7-3-1-4-8-16)23-18(21(28)25-11-13-30-14-12-25)15-19-22(29)31-24-26(19)17-9-5-2-6-10-17/h1-10,15H,11-14H2/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CCOCC4 | |
| AKOS005251082 | 420.418 | C22 H20 N4 O5 | QIMZRVPRCOEYKD-UHFFFAOYSA-O | InChI=1S/C22H19N4O5/c1-30-17-11-9-16(10-12-17)26-19(22(29)31-25-26)13-18(21(28)23-15-7-8-15)24-20(27)14-5-3-2-4-6-14/h2-6,9-13,15H,7-8H2,1H3,(H,23,28)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NC3CC3)\NC(=O)c4ccccc4 | |
| AKOS005251084 | 420.418 | C22 H20 N4 O5 | BPLNKLANOKRECE-UHFFFAOYSA-O | InChI=1S/C22H19N4O5/c1-3-13-23-21(28)18(24-20(27)15-7-5-4-6-8-15)14-19-22(29)31-25-26(19)16-9-11-17(30-2)12-10-16/h3-12,14H,1,13H2,2H3,(H,23,28)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCC=C)\NC(=O)c3ccccc3 | |
| AKOS005251269 | 420.418 | C22 H20 N4 O5 | BRPBNAYBBYOHKK-UHFFFAOYSA-N | InChI=1S/C22H20N4O5/c1-14(27)15-8-10-16(11-9-15)25-20(28)12-18(21(25)29)24(2)13-19-22(30)31-23-26(19)17-6-4-3-5-7-17/h3-11,18H,12-13H2,1-2H3 | CC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)N(C)Cc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005253166 | 436.417 | C22 H20 N4 O6 | INKHQEZWGAFZAI-UHFFFAOYSA-N | InChI=1S/C22H20N4O6/c1-2-31-21(29)14-8-10-15(11-9-14)25-19(27)12-17(20(25)28)23-13-18-22(30)32-24-26(18)16-6-4-3-5-7-16/h3-11,17,23H,2,12-13H2,1H3 | CCOC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)NCc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005253173 | 436.417 | C22 H20 N4 O6 | VIWQIDCQKASRMQ-UHFFFAOYSA-N | InChI=1S/C22H20N4O6/c1-13(27)14-3-5-15(6-4-14)25-20(28)11-18(21(25)29)23-12-19-22(30)32-24-26(19)16-7-9-17(31-2)10-8-16/h3-10,18,23H,11-12H2,1-2H3 | CC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)NCc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005253174 | 452.417 | C22 H20 N4 O7 | SNGSPUVCGGGVLD-UHFFFAOYSA-N | InChI=1S/C22H20N4O7/c1-31-16-9-7-15(8-10-16)26-18(22(30)33-24-26)12-23-17-11-19(27)25(20(17)28)14-5-3-13(4-6-14)21(29)32-2/h3-10,17,23H,11-12H2,1-2H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)C(=O)OC | |
| AKOS005252899 | 432.498 | C22 H20 N6 O2 S | KGFCTFMDILABST-UHFFFAOYSA-N | InChI=1S/C22H20N6O2S/c1-15(2)28-13-19(30-27-28)23-18(29)14-31-22-24-20(16-9-5-3-6-10-16)21(25-26-22)17-11-7-4-8-12-17/h3-13,15H,14H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nc(c(nn2)c3ccccc3)c4ccccc4 | |
| AKOS005252667 | 448.498 | C22 H20 N6 O3 S | UKOMCBPDFRGNJA-LDADJPATSA-N | InChI=1S/C22H20N6O3S/c1-15(2)27-13-20(31-26-27)25-19(29)14-32-22-24-18(12-16-8-6-7-11-23-16)21(30)28(22)17-9-4-3-5-10-17/h3-13,15H,14H2,1-2H3/b18-12+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccn3)/C(=O)N2c4ccccc4 | |
| AKOS005252668 | 448.498 | C22 H20 N6 O3 S | SPOMIYKBAZEVMD-WOJGMQOQSA-N | InChI=1S/C22H20N6O3S/c1-15(2)27-13-20(31-26-27)25-19(29)14-32-22-24-18(11-16-7-6-10-23-12-16)21(30)28(22)17-8-4-3-5-9-17/h3-13,15H,14H2,1-2H3/b18-11+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccnc3)/C(=O)N2c4ccccc4 | |
| AKOS005252712 | 448.498 | C22 H20 N6 O3 S | FICZCEPFUFTUGJ-QGOAFFKASA-N | InChI=1S/C22H20N6O3S/c1-26(2)27-14-20(31-25-27)24-19(29)15-32-22-23-18(13-16-9-5-3-6-10-16)21(30)28(22)17-11-7-4-8-12-17/h3-14H,15H2,1-2H3/b18-13+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3)/C(=O)N2c4ccccc4 | |
| AKOS005252774 | 448.498 | C22 H20 N6 O3 S | GFDRZRYVUXMFGI-LDADJPATSA-N | InChI=1S/C22H20N6O3S/c1-15(2)27-13-20(31-26-27)25-19(29)14-32-22-24-18(12-16-8-10-23-11-9-16)21(30)28(22)17-6-4-3-5-7-17/h3-13,15H,14H2,1-2H3/b18-12+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccncc3)/C(=O)N2c4ccccc4 | |
| AKOS005253404 | 448.498 | C22 H20 N6 O3 S | RZQUZTWVGPSRCE-UHFFFAOYSA-N | InChI=1S/C22H20N6O3S/c1-30-13-12-28-14-19(31-27-28)23-18(29)15-32-22-24-20(16-8-4-2-5-9-16)21(25-26-22)17-10-6-3-7-11-17/h2-11,14H,12-13,15H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2nc(c(nn2)c3ccccc3)c4ccccc4 | |
| AKOS005253034 | 464.497 | C22 H20 N6 O4 S | GXOPARXILUSLFF-UHFFFAOYSA-N | InChI=1S/C22H20N6O4S/c29-19(24-20-14-27(25-32-20)26-10-12-31-13-11-26)15-33-22-23-18-9-5-4-8-17(18)21(30)28(22)16-6-2-1-3-7-16/h1-9,14H,10-13,15H2 | c1ccc(cc1)n2c(=O)c3ccccc3nc2SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005253320 | 464.497 | C22 H20 N6 O4 S | CRRADAMVXRMWGS-QGOAFFKASA-N | InChI=1S/C22H20N6O4S/c1-31-12-11-27-14-20(32-26-27)25-19(29)15-33-22-24-18(13-16-7-9-23-10-8-16)21(30)28(22)17-5-3-2-4-6-17/h2-10,13-14H,11-12,15H2,1H3/b18-13+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccncc3)/C(=O)N2c4ccccc4 | |
| AKOS005253382 | 464.497 | C22 H20 N6 O4 S | PSDYGAKUDNZLHF-QGOAFFKASA-N | InChI=1S/C22H20N6O4S/c1-31-12-11-27-14-20(32-26-27)25-19(29)15-33-22-24-18(13-16-7-5-6-10-23-16)21(30)28(22)17-8-3-2-4-9-17/h2-10,13-14H,11-12,15H2,1H3/b18-13+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccn3)/C(=O)N2c4ccccc4 | |
| AKOS005253383 | 464.497 | C22 H20 N6 O4 S | UPOBCSFLBGYJNV-LDADJPATSA-N | InChI=1S/C22H20N6O4S/c1-31-11-10-27-14-20(32-26-27)25-19(29)15-33-22-24-18(12-16-6-5-9-23-13-16)21(30)28(22)17-7-3-2-4-8-17/h2-9,12-14H,10-11,15H2,1H3/b18-12+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccnc3)/C(=O)N2c4ccccc4 | |
| AKOS005252973 | 496.562 | C22 H20 N6 O4 S2 | MGVPZIBATNYXID-QGOAFFKASA-N | InChI=1S/C22H20N6O4S2/c29-19(24-20-14-27(25-32-20)26-8-10-31-11-9-26)15-34-22-23-18(13-17-7-4-12-33-17)21(30)28(22)16-5-2-1-3-6-16/h1-7,12-14H,8-11,15H2/b18-13+ | c1ccc(cc1)N2C(=O)/C(=C\c3cccs3)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005253013 | 480.496 | C22 H20 N6 O5 S | JOBDGXXOLPSTMX-QGOAFFKASA-N | InChI=1S/C22H20N6O5S/c29-19(24-20-14-27(25-33-20)26-8-11-31-12-9-26)15-34-22-23-18(13-17-7-4-10-32-17)21(30)28(22)16-5-2-1-3-6-16/h1-7,10,13-14H,8-9,11-12,15H2/b18-13+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccco3)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005253931 | 480.496 | C22 H20 N6 O5 S | LDZYNRGMZHYKTI-UHFFFAOYSA-N | InChI=1S/C22H20N6O5S/c1-26-17(21(32)33-25-26)12-27-16(20(31)28(22(27)34)15-5-3-2-4-6-15)11-18(29)24-14-9-7-13(8-10-14)19(23)30/h2-10,16H,11-12H2,1H3,(H3-,23,24,25,29,30,32) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)c3ccccc3)CC(=O)Nc4ccc(cc4)C(=O)N | |
| AKOS005253825 | 496.496 | C22 H20 N6 O6 S | WNHIJFQAGKNVLR-UHFFFAOYSA-N | InChI=1S/C22H20N6O6S/c1-13-3-7-15(8-4-13)27-20(30)17(26(22(27)35)12-18-21(31)34-24-25(18)2)11-19(29)23-14-5-9-16(10-6-14)28(32)33/h3-10,17H,11-12H2,1-2H3,(H-,23,24,29,31) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)N(=O)=O | |
| AKOS005253060 | 460.512 | C22 H20 N8 O2 S | AQQLVSNFBRYISU-UHFFFAOYSA-N | InChI=1S/C22H20N8O2S/c23-11-16-20(15-7-3-1-4-8-15)17(12-24)22(27-21(16)25)33-14-18(31)26-19-13-30(28-32-19)29-9-5-2-6-10-29/h1,3-4,7-8,13H,2,5-6,9-10,14H2,(H2-,25,26,27,28,31) | c1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)N)C#N | |
| AKOS005252987 | 476.511 | C22 H20 N8 O3 S | NCGCPMKTYWODIB-UHFFFAOYSA-N | InChI=1S/C22H20N8O3S/c1-14-2-4-15(5-3-14)20-16(10-23)21(25)27-22(17(20)11-24)34-13-18(31)26-19-12-30(28-33-19)29-6-8-32-9-7-29/h2-5,12H,6-9,13H2,1H3,(H2-,25,26,27,28,31) | Cc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)N)C#N | |
| AKOS005253580 | 517.329 | C22 H21 Br N4 O6 | PZOZNQRGTAKULO-UHFFFAOYSA-N | InChI=1S/C22H21BrN4O6/c1-31-17-8-6-16(7-9-17)27-18(22(30)33-25-27)13-26-10-11-32-19(21(26)29)12-20(28)24-15-4-2-14(23)3-5-15/h2-9,19H,10-13H2,1H3,(H-,24,25,28,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)Br | |
| AKOS005253579 | 472.878 | C22 H21 Cl N4 O6 | LVUBLRAAGRAVLT-UHFFFAOYSA-N | InChI=1S/C22H21ClN4O6/c1-31-17-8-6-16(7-9-17)27-18(22(30)33-25-27)13-26-10-11-32-19(21(26)29)12-20(28)24-15-4-2-14(23)3-5-15/h2-9,19H,10-13H2,1H3,(H-,24,25,28,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)Cl | |
| AKOS005253588 | 456.424 | C22 H21 F N4 O6 | QTXUTBLXEDBNER-UHFFFAOYSA-N | InChI=1S/C22H21FN4O6/c1-31-17-8-6-16(7-9-17)27-18(22(30)33-25-27)13-26-10-11-32-19(21(26)29)12-20(28)24-15-4-2-14(23)3-5-15/h2-9,19H,10-13H2,1H3,(H-,24,25,28,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)F | |
| AKOS005253587 | 564.33 | C22 H21 I N4 O6 | SJZGOOYBVGSYGQ-UHFFFAOYSA-N | InChI=1S/C22H21IN4O6/c1-31-17-8-6-16(7-9-17)27-18(22(30)33-25-27)13-26-10-11-32-19(21(26)29)12-20(28)24-15-4-2-14(23)3-5-15/h2-9,19H,10-13H2,1H3,(H-,24,25,28,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)I | |
| AKOS005250288 | 391.42 | C22 H21 N3 O4 | WAINOPBCDCNIOL-VGOFMYFVSA-N | InChI=1S/C22H21N3O4/c1-28-19-12-10-18(11-13-19)25-20(22(27)29-23-25)15-24(17-8-9-17)21(26)14-7-16-5-3-2-4-6-16/h2-7,10-14,17H,8-9,15H2,1H3/b14-7+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)/C=C/c4ccccc4 | |
| AKOS005252499 | 419.499 | C22 H21 N5 O2 S | UGXXOMVDLXOILC-UHFFFAOYSA-N | InChI=1S/C22H21N5O2S/c1-2-27-13-21(29-26-27)25-20(28)14-30-22-18(12-23)11-17-10-16(8-9-19(17)24-22)15-6-4-3-5-7-15/h3-7,11,13,16H,2,8-10,14H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCC(C3)c4ccccc4)C#N | |
| AKOS005252891 | 419.499 | C22 H21 N5 O2 S | UIFIDHVEAIJFLU-UHFFFAOYSA-N | InChI=1S/C22H21N5O2S/c1-15(2)27-13-19(29-26-27)23-18(28)14-30-22-24-20(16-9-5-3-6-10-16)21(25-22)17-11-7-4-8-12-17/h3-13,15H,14H2,1-2H3,(H-,23,24,25,26,28) | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2[nH]c(c(n2)c3ccccc3)c4ccccc4 | |
| AKOS005253394 | 435.499 | C22 H21 N5 O3 S | MZADOBJVCBVITI-UHFFFAOYSA-N | InChI=1S/C22H21N5O3S/c1-29-13-12-27-14-19(30-26-27)23-18(28)15-31-22-24-20(16-8-4-2-5-9-16)21(25-22)17-10-6-3-7-11-17/h2-11,14H,12-13,15H2,1H3,(H-,23,24,25,26,28) | COCC[n+]1cc(on1)[N-]C(=O)CSc2[nH]c(c(n2)c3ccccc3)c4ccccc4 | |
| AKOS005253818 | 451.498 | C22 H21 N5 O4 S | GHUNOPPWFJDGFZ-UHFFFAOYSA-N | InChI=1S/C22H21N5O4S/c1-14-8-10-16(11-9-14)27-20(29)17(12-19(28)23-15-6-4-3-5-7-15)26(22(27)32)13-18-21(30)31-24-25(18)2/h3-11,17H,12-13H2,1-2H3,(H-,23,24,28,30) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccccc4 | |
| AKOS005253911 | 451.498 | C22 H21 N5 O4 S | JHQGGVXCJMYBQD-UHFFFAOYSA-N | InChI=1S/C22H21N5O4S/c1-14-8-10-15(11-9-14)23-19(28)12-17-20(29)27(16-6-4-3-5-7-16)22(32)26(17)13-18-21(30)31-24-25(18)2/h3-11,17H,12-13H2,1-2H3,(H-,23,24,28,30) | Cc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])c4ccccc4 | |
| AKOS005251971 | 483.563 | C22 H21 N5 O4 S2 | IIYKAXJGFNDXGX-UHFFFAOYSA-N | InChI=1S/C22H21N5O4S2/c1-3-17(33-21-22(30)31-25-27(21)14-7-5-4-6-8-14)19(29)24-20-16(11-23)15-9-10-26(13(2)28)12-18(15)32-20/h4-8,17H,3,9-10,12H2,1-2H3,(H-,24,25,29,30) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)C)C#N)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251017 | 435.433 | C22 H21 N5 O5 | XPIMQJVKUJQCFZ-UHFFFAOYSA-O | InChI=1S/C22H20N5O5/c28-20(16-7-3-1-4-8-16)23-18(21(29)24-26-11-13-31-14-12-26)15-19-22(30)32-25-27(19)17-9-5-2-6-10-17/h1-10,15H,11-14H2,(H,24,29)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NN4CCOCC4 | |
| AKOS005251286 | 435.433 | C22 H21 N5 O5 | LPUWAFAFUYRROQ-UHFFFAOYSA-N | InChI=1S/C22H21N5O5/c1-14(28)23-15-8-10-16(11-9-15)26-20(29)12-18(21(26)30)25(2)13-19-22(31)32-24-27(19)17-6-4-3-5-7-17/h3-11,18H,12-13H2,1-2H3,(H-,23,24,28,31) | CC(=O)Nc1ccc(cc1)N2C(=O)CC(C2=O)N(C)Cc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005253917 | 467.498 | C22 H21 N5 O5 S | JUWSCLXAXPDFLO-UHFFFAOYSA-N | InChI=1S/C22H21N5O5S/c1-25-18(21(30)32-24-25)13-26-17(12-19(28)23-14-8-10-16(31-2)11-9-14)20(29)27(22(26)33)15-6-4-3-5-7-15/h3-11,17H,12-13H2,1-2H3,(H-,23,24,28,30) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)c3ccccc3)CC(=O)Nc4ccc(cc4)OC | |
| AKOS005251714 | 499.563 | C22 H21 N5 O5 S2 | GTAGFNJJOGOULW-UHFFFAOYSA-N | InChI=1S/C22H21N5O5S2/c1-12(33-21-22(30)32-25-27(21)14-4-6-15(31-3)7-5-14)19(29)24-20-17(10-23)16-8-9-26(13(2)28)11-18(16)34-20/h4-7,12H,8-9,11H2,1-3H3,(H-,24,25,29,30) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)C)C#N)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252573 | 499.563 | C22 H21 N5 O5 S2 | ANTVDHWQCIJZLY-UHFFFAOYSA-N | InChI=1S/C22H21N5O5S2/c1-13(28)26-9-7-16-17(11-23)20(34-18(16)12-26)24-19(29)8-10-33-21-22(30)32-25-27(21)14-3-5-15(31-2)6-4-14/h3-6H,7-10,12H2,1-2H3,(H-,24,25,29,30) | CC(=O)N1CCc2c(sc(c2C#N)NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005250895 | 451.432 | C22 H21 N5 O6 | FGCVRKZQAOZGRH-UHFFFAOYSA-O | InChI=1S/C22H20N5O6/c1-25-17(22(31)33-24-25)14-16(23-19(28)15-6-3-2-4-7-15)20(29)26-9-11-27(12-10-26)21(30)18-8-5-13-32-18/h2-8,13-14H,9-12H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCN(CC2)C(=O)c3ccco3)\NC(=O)c4ccccc4 | |
| AKOS005251311 | 451.432 | C22 H21 N5 O6 | OCZGVMIFKNFAOR-UHFFFAOYSA-N | InChI=1S/C22H21N5O6/c1-25(12-18-22(31)33-24-27(18)15-7-9-16(32-2)10-8-15)17-11-19(28)26(21(17)30)14-5-3-13(4-6-14)20(23)29/h3-10,17H,11-12H2,1-2H3,(H2-,23,24,29,31) | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C3CC(=O)N(C3=O)c4ccc(cc4)C(=O)N | |
| AKOS005253176 | 451.432 | C22 H21 N5 O6 | CEEFWUWLCRXGKU-UHFFFAOYSA-N | InChI=1S/C22H21N5O6/c1-13(28)24-14-3-5-15(6-4-14)26-20(29)11-18(21(26)30)23-12-19-22(31)33-25-27(19)16-7-9-17(32-2)10-8-16/h3-10,18,23H,11-12H2,1-2H3,(H-,24,25,28,31) | CC(=O)Nc1ccc(cc1)N2C(=O)CC(C2=O)NCc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005253611 | 451.432 | C22 H21 N5 O6 | AKAXWUGOPUUKCE-UHFFFAOYSA-N | InChI=1S/C22H21N5O6/c23-20(29)14-6-8-15(9-7-14)24-19(28)12-18-21(30)26(10-11-32-18)13-17-22(31)33-25-27(17)16-4-2-1-3-5-16/h1-9,18H,10-13H2,(H3-,23,24,25,28,29,31) | c1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)C(=O)N | |
| AKOS005253610 | 483.431 | C22 H21 N5 O8 | UOFGKCNRKZEKAE-UHFFFAOYSA-N | InChI=1S/C22H21N5O8/c1-33-17-8-6-15(7-9-17)26-18(22(30)35-24-26)13-25-10-11-34-19(21(25)29)12-20(28)23-14-2-4-16(5-3-14)27(31)32/h2-9,19H,10-13H2,1H3,(H-,23,24,28,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)N(=O)=O | |
| AKOS005252895 | 447.513 | C22 H21 N7 O2 S | PCBVEQNAAMBSKV-UHFFFAOYSA-N | InChI=1S/C22H21N7O2S/c1-4-14-5-7-15(8-6-14)20-16(9-23)21(25)27-22(17(20)10-24)32-12-18(30)26-19-11-29(13(2)3)28-31-19/h5-8,11,13H,4,12H2,1-3H3,(H2-,25,26,27,28,30) | CCc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)C(C)C)N)C#N | |
| AKOS005252923 | 447.513 | C22 H21 N7 O2 S | CGSAZTRPJBTNMI-UHFFFAOYSA-N | InChI=1S/C22H21N7O2S/c1-4-29-11-19(31-28-29)26-18(30)12-32-22-17(10-24)20(16(9-23)21(25)27-22)15-7-5-14(6-8-15)13(2)3/h5-8,11,13H,4,12H2,1-3H3,(H2-,25,26,27,28,30) | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3ccc(cc3)C(C)C)C#N | |
| AKOS005253194 | 463.512 | C22 H21 N7 O3 S | NEORVFAALNMEBH-UHFFFAOYSA-N | InChI=1S/C22H21N7O3S/c1-5-13-8-6-7-11(2)17(13)26-20(30)12(3)33-21-15(10-24)16(14(9-23)19(25)27-21)18-22(31)32-28-29(18)4/h6-8,12H,5H2,1-4H3,(H3-,25,26,27,28,30,31) | CCc1cccc(c1NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N)C | |
| AKOS005253222 | 463.512 | C22 H21 N7 O3 S | NMDULQYYRCHNHK-UHFFFAOYSA-N | InChI=1S/C22H21N7O3S/c1-11(2)13-5-7-14(8-6-13)26-20(30)12(3)33-21-16(10-24)17(15(9-23)19(25)27-21)18-22(31)32-28-29(18)4/h5-8,11-12H,1-4H3,(H3-,25,26,27,28,30,31) | CC(C)c1ccc(cc1)NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253333 | 463.512 | C22 H21 N7 O3 S | AVNLBPOTDASZSU-UHFFFAOYSA-N | InChI=1S/C22H21N7O3S/c1-3-14-4-6-15(7-5-14)20-16(10-23)21(25)27-22(17(20)11-24)33-13-18(30)26-19-12-29(28-32-19)8-9-31-2/h4-7,12H,3,8-9,13H2,1-2H3,(H2-,25,26,27,28,30) | CCc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)CCOC)N)C#N | |
| AKOS005253441 | 479.512 | C22 H21 N7 O4 S | VOSUUTQWLAZXOY-UHFFFAOYSA-N | InChI=1S/C22H21N7O4S/c1-3-4-9-32-12-7-5-11(6-8-12)26-20(30)18-16(24)15-14(17-22(31)33-28-29(17)2)13(10-23)19(25)27-21(15)34-18/h5-8H,3-4,9H2,1-2H3,(H5-,24,25,26,27,28,30,31) | CCCCOc1ccc(cc1)NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N | |
| AKOS005253571 | 479.512 | C22 H21 N7 O4 S | HZPMNBRNDKBFNS-UHFFFAOYSA-N | InChI=1S/C22H21N7O4S/c1-3-4-9-32-14-7-5-13(6-8-14)26-17(30)12-34-21-16(11-24)18(15(10-23)20(25)27-21)19-22(31)33-28-29(19)2/h5-8H,3-4,9,12H2,1-2H3,(H3-,25,26,27,28,30,31) | CCCCOc1ccc(cc1)NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005252908 | 495.511 | C22 H21 N7 O5 S | SYHUSVNLIISMIJ-UHFFFAOYSA-N | InChI=1S/C22H21N7O5S/c1-5-29-10-18(34-28-29)26-17(30)11-35-22-14(9-24)19(13(8-23)21(25)27-22)12-6-15(31-2)20(33-4)16(7-12)32-3/h6-7,10H,5,11H2,1-4H3,(H2-,25,26,27,28,30) | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3cc(c(c(c3)OC)OC)OC)C#N | |
| AKOS005251945 | 454.565 | C22 H22 N4 O3 S2 | IFFGZOQSXVCYDD-UHFFFAOYSA-N | InChI=1S/C22H22N4O3S2/c1-3-17(31-21-22(28)29-25-26(21)2)19(27)24-20-16(12-23)15-10-9-14(11-18(15)30-20)13-7-5-4-6-8-13/h4-8,14,17H,3,9-11H2,1-2H3,(H-,24,25,27,28) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)c3ccccc3)C#N)Sc4c(on[n+]4C)[O-] | |
| AKOS005251976 | 454.565 | C22 H22 N4 O3 S2 | YCMPOECMIOLYTL-UHFFFAOYSA-N | InChI=1S/C22H22N4O3S2/c1-3-17(31-21-22(28)29-25-26(21)14-7-5-4-6-8-14)19(27)24-20-16(12-23)15-10-9-13(2)11-18(15)30-20/h4-8,13,17H,3,9-11H2,1-2H3,(H-,24,25,27,28) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C)C#N)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250618 | 406.434 | C22 H22 N4 O4 | SYOMKFUNKRYRMO-VAWYXSNFSA-N | InChI=1S/C22H22N4O4/c1-29-19-9-7-18(8-10-19)26-20(22(28)30-23-26)21(27)25-15-13-24(14-16-25)12-11-17-5-3-2-4-6-17/h2-12H,13-16H2,1H3/b12-11+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCN(CC3)/C=C/c4ccccc4 | |
| AKOS005250969 | 406.434 | C22 H22 N4 O4 | AIIHGDQDTISSES-UHFFFAOYSA-O | InChI=1S/C22H21N4O4/c1-3-25(4-2)21(28)18(23-20(27)16-11-7-5-8-12-16)15-19-22(29)30-24-26(19)17-13-9-6-10-14-17/h5-15H,3-4H2,1-2H3/q-1/p+1 | CCN(CC)C(=O)/C(=C/c1c(on[n+]1c2ccccc2)[O-])/NC(=O)c3ccccc3 | |
| AKOS005251023 | 406.434 | C22 H22 N4 O4 | BQQFEGGXQUTMNU-UHFFFAOYSA-O | InChI=1S/C22H21N4O4/c1-3-15(2)23-21(28)18(24-20(27)16-10-6-4-7-11-16)14-19-22(29)30-25-26(19)17-12-8-5-9-13-17/h4-15H,3H2,1-2H3,(H,23,28)/q-1/p+1 | CCC(C)NC(=O)/C(=C/c1c(on[n+]1c2ccccc2)[O-])/NC(=O)c3ccccc3 | |
| AKOS005251030 | 406.434 | C22 H22 N4 O4 | BEGKGLQAWDLAGC-UHFFFAOYSA-O | InChI=1S/C22H21N4O4/c1-22(2,3)24-20(28)17(23-19(27)15-10-6-4-7-11-15)14-18-21(29)30-25-26(18)16-12-8-5-9-13-16/h4-14H,1-3H3,(H,24,28)/q-1/p+1 | CC(C)(C)NC(=O)/C(=C/c1c(on[n+]1c2ccccc2)[O-])/NC(=O)c3ccccc3 | |
| AKOS005251691 | 470.564 | C22 H22 N4 O4 S2 | GNBDTQYEMMEMPJ-UHFFFAOYSA-N | InChI=1S/C22H22N4O4S2/c1-12-4-9-16-17(11-23)20(32-18(16)10-12)24-19(27)13(2)31-21-22(28)30-25-26(21)14-5-7-15(29-3)8-6-14/h5-8,12-13H,4,9-10H2,1-3H3,(H-,24,25,27,28) | CC1CCc2c(sc(c2C#N)NC(=O)C(C)Sc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005252267 | 470.564 | C22 H22 N4 O4 S2 | BWMNZANIPBYJLM-UHFFFAOYSA-N | InChI=1S/C22H22N4O4S2/c1-3-17(19(27)24-20-16(12-23)15-6-4-5-7-18(15)31-20)32-21-22(28)30-25-26(21)13-8-10-14(29-2)11-9-13/h8-11,17H,3-7H2,1-2H3,(H-,24,25,27,28) | CCC(C(=O)Nc1c(c2c(s1)CCCC2)C#N)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252606 | 470.564 | C22 H22 N4 O4 S2 | RYIHHWHCNQPNGR-UHFFFAOYSA-N | InChI=1S/C22H22N4O4S2/c1-13-3-8-16-17(12-23)20(32-18(16)11-13)24-19(27)9-10-31-21-22(28)30-25-26(21)14-4-6-15(29-2)7-5-14/h4-7,13H,3,8-11H2,1-2H3,(H-,24,25,27,28) | CC1CCc2c(sc(c2C#N)NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005219874 | 422.434 | C22 H22 N4 O5 | WIOUKFPYIBKDNA-UHFFFAOYSA-N | InChI=1S/C22H22N4O5/c27-20(14-24(15-21(28)29)16-7-3-1-4-8-16)25(17-11-12-17)13-19-22(30)31-23-26(19)18-9-5-2-6-10-18/h1-10,17H,11-15H2,(H-,23,28,29,30) | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)CN(CC(=O)O)c4ccccc4 | |
| AKOS005219876 | 422.434 | C22 H22 N4 O5 | YKTXCPZDANUJDL-UHFFFAOYSA-N | InChI=1S/C22H22N4O5/c1-15-7-9-16(10-8-15)23-20(27)13-19-21(28)25(11-12-30-19)14-18-22(29)31-24-26(18)17-5-3-2-4-6-17/h2-10,19H,11-14H2,1H3,(H-,23,24,27,29) | Cc1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250602 | 422.434 | C22 H22 N4 O5 | PFUDWFBZASBGHP-UHFFFAOYSA-N | InChI=1S/C22H22N4O5/c1-15(27)16-3-5-17(6-4-16)24-11-13-25(14-12-24)21(28)20-22(29)31-23-26(20)18-7-9-19(30-2)10-8-18/h3-10H,11-14H2,1-2H3 | CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005250922 | 422.434 | C22 H22 N4 O5 | JXDDSNABXMFJPX-UHFFFAOYSA-O | InChI=1S/C22H21N4O5/c1-26-19(22(29)31-25-26)14-18(24-20(27)16-6-4-3-5-7-16)21(28)23-13-12-15-8-10-17(30-2)11-9-15/h3-11,14H,12-13H2,1-2H3,(H,23,28)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCc2ccc(cc2)OC)\NC(=O)c3ccccc3 | |
| AKOS005251033 | 422.434 | C22 H22 N4 O5 | VXTMUHAXKQEREO-UHFFFAOYSA-O | InChI=1S/C22H21N4O5/c1-30-14-8-13-23-21(28)18(24-20(27)16-9-4-2-5-10-16)15-19-22(29)31-25-26(19)17-11-6-3-7-12-17/h2-7,9-12,15H,8,13-14H2,1H3,(H,23,28)/q-1/p+1 | COCCCNC(=O)/C(=C/c1c(on[n+]1c2ccccc2)[O-])/NC(=O)c3ccccc3 | |
| AKOS005251268 | 422.434 | C22 H22 N4 O5 | GNDLKLXCOOEMAZ-UHFFFAOYSA-N | InChI=1S/C22H22N4O5/c1-3-30-17-11-9-15(10-12-17)25-20(27)13-18(21(25)28)24(2)14-19-22(29)31-23-26(19)16-7-5-4-6-8-16/h4-12,18H,3,13-14H2,1-2H3 | CCOc1ccc(cc1)N2C(=O)CC(C2=O)N(C)Cc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251283 | 422.434 | C22 H22 N4 O5 | AGJRQANDAPAZNW-UHFFFAOYSA-N | InChI=1S/C22H22N4O5/c1-14-4-6-15(7-5-14)25-20(27)12-18(21(25)28)24(2)13-19-22(29)31-23-26(19)16-8-10-17(30-3)11-9-16/h4-11,18H,12-13H2,1-3H3 | Cc1ccc(cc1)N2C(=O)CC(C2=O)N(C)Cc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005251359 | 422.434 | C22 H22 N4 O5 | XXZMNWHXDBKDPA-UHFFFAOYSA-O | InChI=1S/C22H21N4O5/c1-26-18(22(29)31-25-26)14-17(24-20(27)16-9-4-3-5-10-16)21(28)23-13-12-15-8-6-7-11-19(15)30-2/h3-11,14H,12-13H2,1-2H3,(H,23,28)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCc2ccccc2OC)\NC(=O)c3ccccc3 | |
| AKOS005219831 | 438.433 | C22 H22 N4 O6 | WHTJNLWBWDKXNO-UHFFFAOYSA-N | InChI=1S/C22H22N4O6/c1-30-17-9-7-16(8-10-17)26-18(22(29)32-24-26)14-25-11-12-31-19(21(25)28)13-20(27)23-15-5-3-2-4-6-15/h2-10,19H,11-14H2,1H3,(H-,23,24,27,29) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccccc4 | |
| AKOS005219878 | 438.433 | C22 H22 N4 O6 | SCMRXLJKJFIZSX-UHFFFAOYSA-N | InChI=1S/C22H22N4O6/c1-30-17-9-7-15(8-10-17)23-20(27)13-19-21(28)25(11-12-31-19)14-18-22(29)32-24-26(18)16-5-3-2-4-6-16/h2-10,19H,11-14H2,1H3,(H-,23,24,27,29) | COc1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251047 | 438.433 | C22 H22 N4 O6 | LCOQNAFKLLWFDR-UHFFFAOYSA-O | InChI=1S/C22H21N4O6/c1-30-19(31-2)14-23-21(28)17(24-20(27)15-9-5-3-6-10-15)13-18-22(29)32-25-26(18)16-11-7-4-8-12-16/h3-13,19H,14H2,1-2H3,(H,23,28)/q-1/p+1 | COC(CNC(=O)/C(=C/c1c(on[n+]1c2ccccc2)[O-])/NC(=O)c3ccccc3)OC | |
| AKOS005251301 | 438.433 | C22 H22 N4 O6 | NUBVWACWXCAILB-UHFFFAOYSA-N | InChI=1S/C22H22N4O6/c1-24(13-19-22(29)32-23-26(19)15-6-10-17(31-3)11-7-15)18-12-20(27)25(21(18)28)14-4-8-16(30-2)9-5-14/h4-11,18H,12-13H2,1-3H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C3CC(=O)N(C3=O)c4ccc(cc4)OC | |
| AKOS005253170 | 438.433 | C22 H22 N4 O6 | QDVRSTHNWMWRKL-UHFFFAOYSA-N | InChI=1S/C22H22N4O6/c1-3-31-17-10-4-14(5-11-17)25-20(27)12-18(21(25)28)23-13-19-22(29)32-24-26(19)15-6-8-16(30-2)9-7-15/h4-11,18,23H,3,12-13H2,1-2H3 | CCOc1ccc(cc1)N2C(=O)CC(C2=O)NCc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005251621 | 502.563 | C22 H22 N4 O6 S2 | FKDCSBSXVBNJOC-UHFFFAOYSA-N | InChI=1S/C22H22N4O6S2/c1-3-31-21(29)18-15-9-10-25(13(2)27)11-16(15)34-19(18)23-17(28)12-33-20-22(30)32-24-26(20)14-7-5-4-6-8-14/h4-8H,3,9-12H2,1-2H3,(H-,23,24,28,29,30) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])CN(CC2)C(=O)C | |
| AKOS005251673 | 502.563 | C22 H22 N4 O6 S2 | BIXULKPMSAGINF-UHFFFAOYSA-N | InChI=1S/C22H22N4O6S2/c1-12(33-20-22(30)32-24-26(20)14-7-5-4-6-8-14)18(28)23-19-17(21(29)31-3)15-9-10-25(13(2)27)11-16(15)34-19/h4-8,12H,9-11H2,1-3H3,(H-,23,24,28,29,30) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)C)C(=O)OC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252578 | 502.563 | C22 H22 N4 O6 S2 | ZGLKVLJJFZNUPI-UHFFFAOYSA-N | InChI=1S/C22H22N4O6S2/c1-13(27)25-10-8-15-16(12-25)34-19(18(15)21(29)31-2)23-17(28)9-11-33-20-22(30)32-24-26(20)14-6-4-3-5-7-14/h3-7H,8-12H2,1-2H3,(H-,23,24,28,29,30) | CC(=O)N1CCc2c(sc(c2C(=O)OC)NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005250188 | 486.498 | C22 H22 N4 O7 S | DWHZACVQMMBEKE-UHFFFAOYSA-N | InChI=1S/C22H22N4O7S/c1-4-32-21(29)17-15-9-10-25(12(2)27)11-16(15)34-20(17)23-19(28)18-22(30)33-24-26(18)13-5-7-14(31-3)8-6-13/h5-8H,4,9-11H2,1-3H3,(H-,23,24,28,29,30) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])CN(CC2)C(=O)C | |
| AKOS005251513 | 518.563 | C22 H22 N4 O7 S2 | QHXTXNURVHAWSB-UHFFFAOYSA-N | InChI=1S/C22H22N4O7S2/c1-12(27)25-9-8-15-16(10-25)35-19(18(15)21(29)32-3)23-17(28)11-34-20-22(30)33-24-26(20)13-4-6-14(31-2)7-5-13/h4-7H,8-11H2,1-3H3,(H-,23,24,28,29,30) | CC(=O)N1CCc2c(sc(c2C(=O)OC)NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005252705 | 434.514 | C22 H22 N6 O2 S | CIRBGLHCJFWJJU-UHFFFAOYSA-N | InChI=1S/C22H22N6O2S/c1-27(2)28-13-21(30-26-28)25-20(29)14-31-22-18(12-23)11-17-10-16(8-9-19(17)24-22)15-6-4-3-5-7-15/h3-7,11,13,16H,8-10,14H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCC(C3)c4ccccc4)C#N | |
| AKOS005253112 | 434.514 | C22 H22 N6 O2 S | IASIDEDQCSJFOY-UHFFFAOYSA-N | InChI=1S/C22H22N6O2S/c1-16-5-7-17(8-6-16)19-10-9-18(13-23)22(24-19)31-15-20(29)25-21-14-28(26-30-21)27-11-3-2-4-12-27/h5-10,14H,2-4,11-12,15H2,1H3 | Cc1ccc(cc1)c2ccc(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)C#N | |
| AKOS005253107 | 450.513 | C22 H22 N6 O3 S | HONCQWNLSLIFQM-UHFFFAOYSA-N | InChI=1S/C22H22N6O3S/c1-30-18-8-5-16(6-9-18)19-10-7-17(13-23)22(24-19)32-15-20(29)25-21-14-28(26-31-21)27-11-3-2-4-12-27/h5-10,14H,2-4,11-12,15H2,1H3 | COc1ccc(cc1)c2ccc(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)C#N | |
| AKOS005250955 | 434.448 | C22 H22 N6 O4 | XUQRSYNUYSBVSP-UHFFFAOYSA-O | InChI=1S/C22H21N6O4/c1-26-18(22(31)32-25-26)15-17(24-20(29)16-7-3-2-4-8-16)21(30)28-13-11-27(12-14-28)19-9-5-6-10-23-19/h2-10,15H,11-14H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCN(CC2)c3ccccn3)\NC(=O)c4ccccc4 | |
| AKOS005253845 | 530.577 | C22 H22 N6 O6 S2 | IHIGECYBUHGNIR-UHFFFAOYSA-N | InChI=1S/C22H22N6O6S2/c1-13-3-7-15(8-4-13)28-20(30)17(27(22(28)35)12-18-21(31)34-25-26(18)2)11-19(29)24-14-5-9-16(10-6-14)36(23,32)33/h3-10,17H,11-12H2,1-2H3,(H3-,23,24,25,29,31,32,33) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)S(=O)(=O)N | |
| AKOS005252739 | 462.527 | C22 H22 N8 O2 S | PDSCCPSFMYGYRM-UHFFFAOYSA-N | InChI=1S/C22H22N8O2S/c1-13(2)14-5-7-15(8-6-14)20-16(9-23)21(25)27-22(17(20)10-24)33-12-18(31)26-19-11-30(28-32-19)29(3)4/h5-8,11,13H,12H2,1-4H3,(H2-,25,26,27,28,31) | CC(C)c1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N(C)C)N)C#N | |
| AKOS005252730 | 510.526 | C22 H22 N8 O5 S | MJWLFCKNAWBBTO-UHFFFAOYSA-N | InChI=1S/C22H22N8O5S/c1-29(2)30-10-18(35-28-30)26-17(31)11-36-22-14(9-24)19(13(8-23)21(25)27-22)12-6-15(32-3)20(34-5)16(7-12)33-4/h6-7,10H,11H2,1-5H3,(H2-,25,26,27,28,31) | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3cc(c(c(c3)OC)OC)OC)C#N | |
| AKOS005250575 | 393.436 | C22 H23 N3 O4 | RSTSIWWJIQXXQL-UHFFFAOYSA-N | InChI=1S/C22H23N3O4/c1-28-19-9-7-18(8-10-19)25-20(22(27)29-23-25)21(26)24-13-11-17(12-14-24)15-16-5-3-2-4-6-16/h2-10,17H,11-15H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)N3CCC(CC3)Cc4ccccc4 | |
| AKOS005251889 | 441.5 | C22 H23 N3 O5 S | NQNGWDOFVSSEGB-UHFFFAOYSA-N | InChI=1S/C22H23N3O5S/c1-3-4-14-29-21(27)16-10-12-17(13-11-16)23-19(26)15(2)31-20-22(28)30-24-25(20)18-8-6-5-7-9-18/h5-13,15H,3-4,14H2,1-2H3,(H-,23,24,26,27,28) | CCCCOC(=O)c1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005252160 | 441.5 | C22 H23 N3 O5 S | JBXFEXZZJMKYJM-UHFFFAOYSA-N | InChI=1S/C22H23N3O5S/c1-2-3-14-29-21(27)16-9-11-17(12-10-16)23-19(26)13-15-31-20-22(28)30-24-25(20)18-7-5-4-6-8-18/h4-12H,2-3,13-15H2,1H3,(H-,23,24,26,27,28) | CCCCOC(=O)c1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251581 | 473.565 | C22 H23 N3 O5 S2 | ZPFIYYWRHIWAKX-UHFFFAOYSA-N | InChI=1S/C22H23N3O5S2/c1-3-29-21(27)18-15-10-9-13(2)11-16(15)32-19(18)23-17(26)12-31-20-22(28)30-24-25(20)14-7-5-4-6-8-14/h4-8,13H,3,9-12H2,1-2H3,(H-,23,24,26,27,28) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])CC(CC2)C | |
| AKOS005251593 | 473.565 | C22 H23 N3 O5 S2 | WDROPJCUFBESNJ-UHFFFAOYSA-N | InChI=1S/C22H23N3O5S2/c1-3-29-21(27)18-15-10-9-14(13-7-5-4-6-8-13)11-16(15)32-19(18)23-17(26)12-31-20-22(28)30-24-25(20)2/h4-8,14H,3,9-12H2,1-2H3,(H-,23,24,26,27,28) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3C)[O-])CC(CC2)c4ccccc4 | |
| AKOS005251619 | 473.565 | C22 H23 N3 O5 S2 | CKCKGYVSFDXTEG-UHFFFAOYSA-N | InChI=1S/C22H23N3O5S2/c1-2-29-21(27)18-15-11-7-4-8-12-16(15)32-19(18)23-17(26)13-31-20-22(28)30-24-25(20)14-9-5-3-6-10-14/h3,5-6,9-10H,2,4,7-8,11-13H2,1H3,(H-,23,24,26,27,28) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])CCCCC2 | |
| AKOS005251626 | 473.565 | C22 H23 N3 O5 S2 | LUTZYSLFWBVBLK-UHFFFAOYSA-N | InChI=1S/C22H23N3O5S2/c1-29-21(27)18-15-11-7-2-3-8-12-16(15)32-19(18)23-17(26)13-31-20-22(28)30-24-25(20)14-9-5-4-6-10-14/h4-6,9-10H,2-3,7-8,11-13H2,1H3,(H-,23,24,26,27,28) | COC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])CCCCCC2 | |
| AKOS005251660 | 473.565 | C22 H23 N3 O5 S2 | MQKHCPIHUSTRNB-UHFFFAOYSA-N | InChI=1S/C22H23N3O5S2/c1-13(31-20-22(28)30-24-25(20)14-9-5-3-6-10-14)18(26)23-19-17(21(27)29-2)15-11-7-4-8-12-16(15)32-19/h3,5-6,9-10,13H,4,7-8,11-12H2,1-2H3,(H-,23,24,26,27,28) | CC(C(=O)Nc1c(c2c(s1)CCCCC2)C(=O)OC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251662 | 473.565 | C22 H23 N3 O5 S2 | YXUPZSIKFKALJQ-UHFFFAOYSA-N | InChI=1S/C22H23N3O5S2/c1-12-9-10-15-16(11-12)32-19(17(15)21(27)29-3)23-18(26)13(2)31-20-22(28)30-24-25(20)14-7-5-4-6-8-14/h4-8,12-13H,9-11H2,1-3H3,(H-,23,24,26,27,28) | CC1CCc2c(sc(c2C(=O)OC)NC(=O)C(C)Sc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005251669 | 473.565 | C22 H23 N3 O5 S2 | RKTXEUDTQQYMBJ-UHFFFAOYSA-N | InChI=1S/C22H23N3O5S2/c1-3-29-21(27)17-15-11-7-8-12-16(15)32-19(17)23-18(26)13(2)31-20-22(28)30-24-25(20)14-9-5-4-6-10-14/h4-6,9-10,13H,3,7-8,11-12H2,1-2H3,(H-,23,24,26,27,28) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccccc4)[O-])CCCC2 | |
| AKOS005251809 | 473.565 | C22 H23 N3 O5 S2 | ULBSYRNUIGXIPE-UHFFFAOYSA-N | InChI=1S/C22H23N3O5S2/c1-12(31-20-22(28)30-24-25(20)2)18(26)23-19-17(21(27)29-3)15-10-9-14(11-16(15)32-19)13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3,(H-,23,24,26,27,28) | CC(C(=O)Nc1c(c2c(s1)CC(CC2)c3ccccc3)C(=O)OC)Sc4c(on[n+]4C)[O-] | |
| AKOS005251949 | 473.565 | C22 H23 N3 O5 S2 | KPXKYUDKXZRJOD-UHFFFAOYSA-N | InChI=1S/C22H23N3O5S2/c1-3-15(32-20-22(28)30-24-25(20)13-9-5-4-6-10-13)18(26)23-19-17(21(27)29-2)14-11-7-8-12-16(14)31-19/h4-6,9-10,15H,3,7-8,11-12H2,1-2H3,(H-,23,24,26,27,28) | CCC(C(=O)Nc1c(c2c(s1)CCCC2)C(=O)OC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252549 | 473.565 | C22 H23 N3 O5 S2 | KOGBABXPSSHCPQ-UHFFFAOYSA-N | InChI=1S/C22H23N3O5S2/c1-29-21(27)18-15-10-6-3-7-11-16(15)32-19(18)23-17(26)12-13-31-20-22(28)30-24-25(20)14-8-4-2-5-9-14/h2,4-5,8-9H,3,6-7,10-13H2,1H3,(H-,23,24,26,27,28) | COC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])CCCCC2 | |
| AKOS005252555 | 473.565 | C22 H23 N3 O5 S2 | LQNAQIIVHQWWRB-UHFFFAOYSA-N | InChI=1S/C22H23N3O5S2/c1-13-8-9-15-16(12-13)32-19(18(15)21(27)29-2)23-17(26)10-11-31-20-22(28)30-24-25(20)14-6-4-3-5-7-14/h3-7,13H,8-12H2,1-2H3,(H-,23,24,26,27,28) | CC1CCc2c(sc(c2C(=O)OC)NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005252562 | 473.565 | C22 H23 N3 O5 S2 | LTWWMBGOLITQFT-UHFFFAOYSA-N | InChI=1S/C22H23N3O5S2/c1-2-29-21(27)18-15-10-6-7-11-16(15)32-19(18)23-17(26)12-13-31-20-22(28)30-24-25(20)14-8-4-3-5-9-14/h3-5,8-9H,2,6-7,10-13H2,1H3,(H-,23,24,26,27,28) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])CCCC2 | |
| AKOS005252652 | 473.565 | C22 H23 N3 O5 S2 | PZQSVJFSHUBFOM-UHFFFAOYSA-N | InChI=1S/C22H23N3O5S2/c1-25-20(22(28)30-24-25)31-11-10-17(26)23-19-18(21(27)29-2)15-9-8-14(12-16(15)32-19)13-6-4-3-5-7-13/h3-7,14H,8-12H2,1-2H3,(H-,23,24,26,27,28) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2c(c3c(s2)CC(CC3)c4ccccc4)C(=O)OC | |
| AKOS005250297 | 425.435 | C22 H23 N3 O6 | OCBCWKDCPZRLBB-UHFFFAOYSA-N | InChI=1S/C22H23N3O6/c1-28-17-9-7-16(8-10-17)25-18(22(27)31-23-25)13-24(15-5-6-15)21(26)14-4-11-19(29-2)20(12-14)30-3/h4,7-12,15H,5-6,13H2,1-3H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4ccc(c(c4)OC)OC | |
| AKOS005250299 | 425.435 | C22 H23 N3 O6 | NDPPQUQVAAFQFY-UHFFFAOYSA-N | InChI=1S/C22H23N3O6/c1-28-16-11-9-15(10-12-16)25-17(22(27)31-23-25)13-24(14-7-8-14)21(26)20-18(29-2)5-4-6-19(20)30-3/h4-6,9-12,14H,7-8,13H2,1-3H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4c(cccc4OC)OC | |
| AKOS005250148 | 457.5 | C22 H23 N3 O6 S | ZKYANIALYBVUAG-UHFFFAOYSA-N | InChI=1S/C22H23N3O6S/c1-4-30-21(27)17-15-10-5-12(2)11-16(15)32-20(17)23-19(26)18-22(28)31-24-25(18)13-6-8-14(29-3)9-7-13/h6-9,12H,4-5,10-11H2,1-3H3,(H-,23,24,26,27,28) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])CC(CC2)C | |
| AKOS005250202 | 457.5 | C22 H23 N3 O6 S | QTYYLYDRGJCUIJ-UHFFFAOYSA-N | InChI=1S/C22H23N3O6S/c1-3-30-21(27)17-15-7-5-4-6-8-16(15)32-20(17)23-19(26)18-22(28)31-24-25(18)13-9-11-14(29-2)12-10-13/h9-12H,3-8H2,1-2H3,(H-,23,24,26,27,28) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])CCCCC2 | |
| AKOS005250209 | 457.5 | C22 H23 N3 O6 S | ZVECRZJICLZHJK-UHFFFAOYSA-N | InChI=1S/C22H23N3O6S/c1-29-14-11-9-13(10-12-14)25-18(22(28)31-24-25)19(26)23-20-17(21(27)30-2)15-7-5-3-4-6-8-16(15)32-20/h9-12H,3-8H2,1-2H3,(H-,23,24,26,27,28) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3c(c4c(s3)CCCCCC4)C(=O)OC | |
| AKOS005251590 | 457.5 | C22 H23 N3 O6 S | ZNTFSRUGKLUEPF-UHFFFAOYSA-N | InChI=1S/C22H23N3O6S/c1-3-4-13-30-21(27)15-5-7-16(8-6-15)23-19(26)14-32-20-22(28)31-24-25(20)17-9-11-18(29-2)12-10-17/h5-12H,3-4,13-14H2,1-2H3,(H-,23,24,26,27,28) | CCCCOC(=O)c1ccc(cc1)NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252067 | 457.5 | C22 H23 N3 O6 S | XMSRNEDLNVNTPX-UHFFFAOYSA-N | InChI=1S/C22H23N3O6S/c1-4-18(19(26)23-15-8-6-14(7-9-15)21(27)30-5-2)32-20-22(28)31-24-25(20)16-10-12-17(29-3)13-11-16/h6-13,18H,4-5H2,1-3H3,(H-,23,24,26,27,28) | CCC(C(=O)Nc1ccc(cc1)C(=O)OCC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251518 | 489.565 | C22 H23 N3 O6 S2 | LCYRSPXTJJPTFS-UHFFFAOYSA-N | InChI=1S/C22H23N3O6S2/c1-12-4-9-15-16(10-12)33-19(18(15)21(27)30-3)23-17(26)11-32-20-22(28)31-24-25(20)13-5-7-14(29-2)8-6-13/h5-8,12H,4,9-11H2,1-3H3,(H-,23,24,26,27,28) | CC1CCc2c(sc(c2C(=O)OC)NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005251523 | 489.565 | C22 H23 N3 O6 S2 | AZHYDMPRBDYNAN-UHFFFAOYSA-N | InChI=1S/C22H23N3O6S2/c1-29-14-10-8-13(9-11-14)25-20(22(28)31-24-25)32-12-17(26)23-19-18(21(27)30-2)15-6-4-3-5-7-16(15)33-19/h8-11H,3-7,12H2,1-2H3,(H-,23,24,26,27,28) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3c(c4c(s3)CCCCC4)C(=O)OC | |
| AKOS005251526 | 489.565 | C22 H23 N3 O6 S2 | HXOIYDPRPBFKRI-UHFFFAOYSA-N | InChI=1S/C22H23N3O6S2/c1-3-30-21(27)18-15-6-4-5-7-16(15)33-19(18)23-17(26)12-32-20-22(28)31-24-25(20)13-8-10-14(29-2)11-9-13/h8-11H,3-7,12H2,1-2H3,(H-,23,24,26,27,28) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])CCCC2 | |
| AKOS005251706 | 489.565 | C22 H23 N3 O6 S2 | QPMZLYKGKMGOFF-UHFFFAOYSA-N | InChI=1S/C22H23N3O6S2/c1-12(32-20-22(28)31-24-25(20)13-8-10-14(29-2)11-9-13)18(26)23-19-17(21(27)30-3)15-6-4-5-7-16(15)33-19/h8-12H,4-7H2,1-3H3,(H-,23,24,26,27,28) | CC(C(=O)Nc1c(c2c(s1)CCCC2)C(=O)OC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252631 | 489.565 | C22 H23 N3 O6 S2 | YWAOKJQACLZYEE-UHFFFAOYSA-N | InChI=1S/C22H23N3O6S2/c1-29-14-9-7-13(8-10-14)25-20(22(28)31-24-25)32-12-11-17(26)23-19-18(21(27)30-2)15-5-3-4-6-16(15)33-19/h7-10H,3-6,11-12H2,1-2H3,(H-,23,24,26,27,28) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3c(c4c(s3)CCCC4)C(=O)OC | |
| AKOS005251953 | 469.58 | C22 H23 N5 O3 S2 | RDFJCMNYQHEEAY-UHFFFAOYSA-N | InChI=1S/C22H23N5O3S2/c1-3-17(32-21-22(29)30-25-26(21)2)19(28)24-20-16(11-23)15-9-10-27(13-18(15)31-20)12-14-7-5-4-6-8-14/h4-8,17H,3,9-10,12-13H2,1-2H3,(H-,24,25,28,29) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)Cc3ccccc3)C#N)Sc4c(on[n+]4C)[O-] | |
| AKOS005251024 | 421.449 | C22 H23 N5 O4 | NSPMUSDAWMNARS-UHFFFAOYSA-O | InChI=1S/C22H22N5O4/c1-26(2)14-13-23-21(29)18(24-20(28)16-9-5-3-6-10-16)15-19-22(30)31-25-27(19)17-11-7-4-8-12-17/h3-12,15H,13-14H2,1-2H3,(H,23,29)/q-1/p+1 | CN(C)CCNC(=O)/C(=C/c1c(on[n+]1c2ccccc2)[O-])/NC(=O)c3ccccc3 | |
| AKOS005253595 | 517.512 | C22 H23 N5 O8 S | SULYHHPIMMZWHE-UHFFFAOYSA-N | InChI=1S/C22H23N5O8S/c1-33-16-6-4-15(5-7-16)27-18(22(30)35-25-27)13-26-10-11-34-19(21(26)29)12-20(28)24-14-2-8-17(9-3-14)36(23,31)32/h2-9,19H,10-13H2,1H3,(H3-,23,24,25,28,30,31,32) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)S(=O)(=O)N | |
| AKOS005250617 | 408.45 | C22 H24 N4 O4 | JLTAVNAGADJLRE-UHFFFAOYSA-N | InChI=1S/C22H24N4O4/c1-15-4-5-16(2)19(14-15)24-10-12-25(13-11-24)21(27)20-22(28)30-23-26(20)17-6-8-18(29-3)9-7-17/h4-9,14H,10-13H2,1-3H3 | Cc1ccc(c(c1)N2CCN(CC2)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])C | |
| AKOS005250640 | 408.45 | C22 H24 N4 O4 | AFWPWJFERBFHJV-UHFFFAOYSA-N | InChI=1S/C22H24N4O4/c1-29-19-9-7-18(8-10-19)26-20(22(28)30-24-26)21(27)23-17-11-13-25(14-12-17)15-16-5-3-2-4-6-16/h2-10,17H,11-15H2,1H3,(H-,23,24,27,28) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)NC3CCN(CC3)Cc4ccccc4 | |
| AKOS005251617 | 488.58 | C22 H24 N4 O5 S2 | ZIDZSINMVCFEHA-UHFFFAOYSA-N | InChI=1S/C22H24N4O5S2/c1-3-30-21(28)18-15-9-10-26(11-14-7-5-4-6-8-14)12-16(15)33-19(18)23-17(27)13-32-20-22(29)31-24-25(20)2/h4-8H,3,9-13H2,1-2H3,(H-,23,24,27,28,29) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3C)[O-])CN(CC2)Cc4ccccc4 | |
| AKOS005251759 | 488.58 | C22 H24 N4 O5 S2 | CWVHXBRNPPOTTK-UHFFFAOYSA-N | InChI=1S/C22H24N4O5S2/c1-13(32-20-22(29)31-24-25(20)2)18(27)23-19-17(21(28)30-3)15-9-10-26(12-16(15)33-19)11-14-7-5-4-6-8-14/h4-8,13H,9-12H2,1-3H3,(H-,23,24,27,28,29) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)Cc3ccccc3)C(=O)OC)Sc4c(on[n+]4C)[O-] | |
| AKOS005252646 | 488.58 | C22 H24 N4 O5 S2 | MKPHROYSTWPMBG-UHFFFAOYSA-N | InChI=1S/C22H24N4O5S2/c1-25-20(22(29)31-24-25)32-11-9-17(27)23-19-18(21(28)30-2)15-8-10-26(13-16(15)33-19)12-14-6-4-3-5-7-14/h3-7H,8-13H2,1-2H3,(H-,23,24,27,28,29) | C[n+]1c(c(on1)[O-])SCCC(=O)Nc2c(c3c(s2)CN(CC3)Cc4ccccc4)C(=O)OC | |
| AKOS005251962 | 504.579 | C22 H24 N4 O6 S2 | FFMJGGHIZVAZLT-UHFFFAOYSA-N | InChI=1S/C22H24N4O6S2/c1-5-14(33-20-22(30)32-25-26(20)4)17(27)24-19-15(21(29)31-6-2)12(3)16(34-19)18(28)23-13-10-8-7-9-11-13/h7-11,14H,5-6H2,1-4H3,(H2-,23,24,25,27,28,29,30) | CCC(C(=O)Nc1c(c(c(s1)C(=O)Nc2ccccc2)C)C(=O)OCC)Sc3c(on[n+]3C)[O-] | |
| AKOS005219810 | 456.449 | C22 H24 N4 O7 | ULPMHGJNZKQVRD-UHFFFAOYSA-N | InChI=1S/C22H24N4O7/c1-24(12-19-22(30)33-23-26(19)16-6-10-18(32-3)11-7-16)20(27)13-25(14-21(28)29)15-4-8-17(31-2)9-5-15/h4-11H,12-14H2,1-3H3,(H-,23,28,29,30) | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)CN(CC(=O)O)c3ccc(cc3)OC | |
| AKOS005219840 | 456.449 | C22 H24 N4 O7 | KMHQVEFBKGDGRE-UHFFFAOYSA-N | InChI=1S/C22H24N4O7/c1-24(12-19-22(30)33-23-26(19)15-7-9-17(31-2)10-8-15)20(27)13-25(14-21(28)29)16-5-4-6-18(11-16)32-3/h4-11H,12-14H2,1-3H3,(H-,23,28,29,30) | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C(=O)CN(CC(=O)O)c3cccc(c3)OC | |
| AKOS005252052 | 427.517 | C22 H25 N3 O4 S | BYYDJAFIZFKXIL-UHFFFAOYSA-N | InChI=1S/C22H25N3O4S/c1-5-19(20(26)23-16-8-6-15(7-9-16)14(2)3)30-21-22(27)29-24-25(21)17-10-12-18(28-4)13-11-17/h6-14,19H,5H2,1-4H3,(H-,23,24,26,27) | CCC(C(=O)Nc1ccc(cc1)C(C)C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252071 | 427.517 | C22 H25 N3 O4 S | XIYUZRNEQIBPSQ-UHFFFAOYSA-N | InChI=1S/C22H25N3O4S/c1-5-15-9-7-8-14(3)19(15)23-20(26)18(6-2)30-21-22(27)29-24-25(21)16-10-12-17(28-4)13-11-16/h7-13,18H,5-6H2,1-4H3,(H-,23,24,26,27) | CCc1cccc(c1NC(=O)C(CC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-])C | |
| AKOS005252098 | 427.517 | C22 H25 N3 O4 S | SIEXGLIGACCUBB-UHFFFAOYSA-N | InChI=1S/C22H25N3O4S/c1-3-5-15-28-18-13-11-16(12-14-18)23-20(26)19(4-2)30-21-22(27)29-24-25(21)17-9-7-6-8-10-17/h6-14,19H,3-5,15H2,1-2H3,(H-,23,24,26,27) | CCCCOc1ccc(cc1)NC(=O)C(CC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251807 | 443.516 | C22 H25 N3 O5 S | XYJPDSCUXXQPRS-UHFFFAOYSA-N | InChI=1S/C22H25N3O5S/c1-4-5-14-29-19-10-6-16(7-11-19)23-20(26)15(2)31-21-22(27)30-24-25(21)17-8-12-18(28-3)13-9-17/h6-13,15H,4-5,14H2,1-3H3,(H-,23,24,26,27) | CCCCOc1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252236 | 443.516 | C22 H25 N3 O5 S | VRPFASKYTMLPPP-UHFFFAOYSA-N | InChI=1S/C22H25N3O5S/c1-3-4-14-29-19-9-5-16(6-10-19)23-20(26)13-15-31-21-22(27)30-24-25(21)17-7-11-18(28-2)12-8-17/h5-12H,3-4,13-15H2,1-2H3,(H-,23,24,26,27) | CCCCOc1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005214745 | 378.467 | C22 H26 N4 O2 | MCHKDXIFJICUHU-UHFFFAOYSA-N | InChI=1S/C22H26N4O2/c1-17-7-9-20(10-8-17)26-21(22(27)28-24-26)15-23-19-11-13-25(14-12-19)16-18-5-3-2-4-6-18/h2-10,19,23H,11-16H2,1H3 | Cc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CCN(CC3)Cc4ccccc4 | |
| AKOS005214753 | 394.467 | C22 H26 N4 O3 | DKECZYVOOKJFRO-UHFFFAOYSA-N | InChI=1S/C22H26N4O3/c1-28-20-9-7-19(8-10-20)26-21(22(27)29-24-26)15-23-18-11-13-25(14-12-18)16-17-5-3-2-4-6-17/h2-10,18,23H,11-16H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CCN(CC3)Cc4ccccc4 | |
| AKOS005250933 | 457.48 | C22 H27 N5 O6 | PQLWQFZJNBAKQT-UHFFFAOYSA-O | InChI=1S/C22H26N5O6/c1-22(2,3)32-21(31)27-12-10-26(11-13-27)19(29)16(14-17-20(30)33-24-25(17)4)23-18(28)15-8-6-5-7-9-15/h5-9,14H,10-13H2,1-4H3/q-1/p+1 | CC(C)(C)OC(=O)N1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2C)[O-])/NC(=O)c3ccccc3 | |
| AKOS005252941 | 456.561 | C22 H28 N6 O3 S | NIXSGTFITDDUBU-UHFFFAOYSA-N | InChI=1S/C22H28N6O3S/c1-22(2,3)17-4-5-18-15(11-17)10-16(12-23)21(24-18)32-14-19(29)25-20-13-28(26-31-20)27-6-8-30-9-7-27/h10,13,17H,4-9,11,14H2,1-3H3 | CC(C)(C)C1CCc2c(cc(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)C#N)C1 | |
| AKOS005251955 | 526.626 | C22 H30 N4 O7 S2 | YSYIAECMBDTSBJ-UHFFFAOYSA-N | InChI=1S/C22H30N4O7S2/c1-7-13(35-18-20(29)33-24-25(18)6)16(27)23-17-15(19(28)31-8-2)12-9-10-26(11-14(12)34-17)21(30)32-22(3,4)5/h13H,7-11H2,1-6H3,(H-,23,24,27,28,29) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)OC(C)(C)C)C(=O)OCC)Sc3c(on[n+]3C)[O-] | |
| AKOS005251990 | 481.629 | C22 H31 N3 O5 S2 | AAJHMVDJHUUGEO-UHFFFAOYSA-N | InChI=1S/C22H31N3O5S2/c1-7-14(32-19-21(28)30-24-25(19)6)17(26)23-18-16(20(27)29-8-2)13-10-9-12(22(3,4)5)11-15(13)31-18/h12,14H,7-11H2,1-6H3,(H-,23,24,26,27,28) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C(C)(C)C)C(=O)OCC)Sc3c(on[n+]3C)[O-] | |
| AKOS005253900 | 498.889 | C23 H13 Cl F2 N4 O3 S | SGUYNVGZGKOVSL-UHFFFAOYSA-N | InChI=1S/C23H13ClF2N4O3S/c1-30-19(23(32)33-29-30)20(31)21-18(27)17-14(13-7-6-12(25)8-15(13)26)9-16(28-22(17)34-21)10-2-4-11(24)5-3-10/h2-9H,1H3,(H2-,27,29,31,32) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4ccc(cc4)Cl)c5ccc(cc5F)F)N | |
| AKOS005253726 | 488.906 | C23 H13 Cl N6 O3 S | DRHVWPMNNNQIQS-UHFFFAOYSA-N | InChI=1S/C23H13ClN6O3S/c24-12-8-6-11(7-9-12)15-14(10-25)21(27)28-22-16(15)17(26)20(34-22)19(31)18-23(32)33-29-30(18)13-4-2-1-3-5-13/h1-9H,(H4-,26,27,28,29,31,32) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(c(c(nc4s3)N)C#N)c5ccc(cc5)Cl)N | |
| AKOS005250812 | 482.435 | C23 H13 F3 N4 O3 S | VNZDVIXJYOSXFH-UHFFFAOYSA-N | InChI=1S/C23H13F3N4O3S/c24-23(25,26)17-11-18(14-7-3-1-4-8-14)28-21(16(17)12-27)34-13-19(31)20-22(32)33-29-30(20)15-9-5-2-6-10-15/h1-11H,13H2 | c1ccc(cc1)c2cc(c(c(n2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])C#N)C(F)(F)F | |
| AKOS005253799 | 482.435 | C23 H13 F3 N4 O3 S | FLHAIPMTAKLJKD-UHFFFAOYSA-N | InChI=1S/C23H13F3N4O3S/c24-23(25,26)14-11-15(12-7-3-1-4-8-12)28-21-16(14)17(27)20(34-21)19(31)18-22(32)33-29-30(18)13-9-5-2-6-10-13/h1-11H,(H2-,27,29,31,32) | c1ccc(cc1)c2cc(c3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)C(F)(F)F | |
| AKOS005250816 | 439.446 | C23 H13 N5 O3 S | FXEQTTYYTWEOAZ-UHFFFAOYSA-N | InChI=1S/C23H13N5O3S/c29-17(21-22(30)31-27-28(21)14-8-2-1-3-9-14)12-32-23-24-19-15-10-4-6-13-7-5-11-16(18(13)15)20(19)25-26-23/h1-11H,12H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nc-4c(nn3)-c5cccc6c5c4ccc6 | |
| AKOS005253876 | 480.899 | C23 H14 Cl F N4 O3 S | WNHQZAGQFFLSPW-UHFFFAOYSA-N | InChI=1S/C23H14ClFN4O3S/c1-29-19(23(31)32-28-29)20(30)21-18(26)17-15(12-3-2-4-14(25)9-12)10-16(27-22(17)33-21)11-5-7-13(24)8-6-11/h2-10H,1H3,(H2-,26,28,30,31) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4ccc(cc4)Cl)c5cccc(c5)F)N | |
| AKOS005215727 | 399.829 | C23 H14 Cl N3 O2 | DBAAHODNNJDVRQ-UHFFFAOYSA-N | InChI=1S/C23H14ClN3O2/c24-19-11-6-18(7-12-19)16-25-20-13-8-17(9-14-20)10-15-22-23(28)29-26-27(22)21-4-2-1-3-5-21/h1-9,11-14,16H | c1ccc(cc1)[n+]2c(c(on2)[O-])C#Cc3ccc(cc3)/N=C/c4ccc(cc4)Cl | MFCD09881643 |
| AKOS005254198 | 513.353 | C23 H14 Cl2 N4 O4 S | IIISNLDSHWBOTO-UHFFFAOYSA-N | InChI=1S/C23H14Cl2N4O4S/c1-32-13-5-3-12(4-6-13)29-19(23(31)33-28-29)20(30)21-18(26)15-8-9-17(27-22(15)34-21)14-7-2-11(24)10-16(14)25/h2-10H,1H3,(H2-,26,28,30,31) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4ccc(nc4s3)c5ccc(cc5Cl)Cl)N | |
| AKOS005253907 | 464.444 | C23 H14 F2 N4 O3 S | DFVURAIYEPCVBW-UHFFFAOYSA-N | InChI=1S/C23H14F2N4O3S/c1-29-19(23(31)32-28-29)20(30)21-18(26)17-14(13-8-7-12(24)9-15(13)25)10-16(27-22(17)33-21)11-5-3-2-4-6-11/h2-10H,1H3,(H2-,26,28,30,31) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4ccccc4)c5ccc(cc5F)F)N | |
| AKOS005253753 | 458.446 | C23 H14 N4 O5 S | GPMCTOYJODBFMV-UHFFFAOYSA-N | InChI=1S/C23H14N4O5S/c24-18-14-7-8-15(12-6-9-16-17(10-12)31-11-30-16)25-22(14)33-21(18)20(28)19-23(29)32-26-27(19)13-4-2-1-3-5-13/h1-10H,11H2,(H2-,24,26,28,29) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4ccc(nc4s3)c5ccc6c(c5)OCO6)N | |
| AKOS005250805 | 454.461 | C23 H14 N6 O3 S | CZHYSPCJPNHYLZ-UHFFFAOYSA-N | InChI=1S/C23H14N6O3S/c24-11-16-19(14-7-3-1-4-8-14)17(12-25)22(27-21(16)26)33-13-18(30)20-23(31)32-28-29(20)15-9-5-2-6-10-15/h1-10H,13H2,(H2-,26,27,28,30,31) | c1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])N)C#N | |
| AKOS005253725 | 454.461 | C23 H14 N6 O3 S | RXPSXUORBAYSDN-UHFFFAOYSA-N | InChI=1S/C23H14N6O3S/c24-11-14-15(12-7-3-1-4-8-12)16-17(25)20(33-22(16)27-21(14)26)19(30)18-23(31)32-28-29(18)13-9-5-2-6-10-13/h1-10H,(H4-,25,26,27,28,30,31) | c1ccc(cc1)c2c(c(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)N)C#N | |
| AKOS005250416 | 478.908 | C23 H15 Cl N4 O4 S | GZKVBYUKHPNIEQ-UHFFFAOYSA-N | InChI=1S/C23H15ClN4O4S/c1-31-18-9-7-17(8-10-18)28-21(23(30)32-27-28)20(29)13-33-22-15(12-25)4-11-19(26-22)14-2-5-16(24)6-3-14/h2-11H,13H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(ccc(n3)c4ccc(cc4)Cl)C#N | |
| AKOS005253709 | 478.908 | C23 H15 Cl N4 O4 S | PFPRDORPUGQZOV-UHFFFAOYSA-N | InChI=1S/C23H15ClN4O4S/c1-31-15-8-6-14(7-9-15)28-19(23(30)32-27-28)20(29)21-18(25)16-10-11-17(26-22(16)33-21)12-2-4-13(24)5-3-12/h2-11H,1H3,(H2-,25,27,29,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4ccc(nc4s3)c5ccc(cc5)Cl)N | |
| AKOS005253909 | 446.454 | C23 H15 F N4 O3 S | XJVXUFJPGDARQT-UHFFFAOYSA-N | InChI=1S/C23H15FN4O3S/c1-28-19(23(30)31-27-28)20(29)21-18(25)17-15(13-8-5-9-14(24)10-13)11-16(26-22(17)32-21)12-6-3-2-4-7-12/h2-11H,1H3,(H2-,25,27,29,30) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4ccccc4)c5cccc(c5)F)N | |
| AKOS005254197 | 462.453 | C23 H15 F N4 O4 S | LUIFYIJTQCMFSA-UHFFFAOYSA-N | InChI=1S/C23H15FN4O4S/c1-31-15-8-6-14(7-9-15)28-19(23(30)32-27-28)20(29)21-18(25)16-10-11-17(26-22(16)33-21)12-2-4-13(24)5-3-12/h2-11H,1H3,(H2-,25,27,29,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4ccc(nc4s3)c5ccc(cc5)F)N | |
| AKOS005219719 | 484.384 | C23 H15 F3 N4 O5 | XJKYKPCVZZTJAM-UHFFFAOYSA-N | InChI=1S/C23H15F3N4O5/c1-33-14-9-7-13(8-10-14)30-18(22(32)35-29-30)16-15(11-27)21(28)34-20(23(24,25)26)17(16)19(31)12-5-3-2-4-6-12/h2-10,16H,28H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C3C(=C(OC(=C3C(=O)c4ccccc4)C(F)(F)F)N)C#N | |
| AKOS005253699 | 469.475 | C23 H15 N7 O3 S | MWCDAOSBONAJND-UHFFFAOYSA-N | InChI=1S/C23H15N7O3S/c1-11-6-5-9-14(27-11)15-13(10-24)21(26)28-22-16(15)17(25)20(34-22)19(31)18-23(32)33-29-30(18)12-7-3-2-4-8-12/h2-9H,1H3,(H4-,25,26,28,29,31,32) | Cc1cccc(n1)c2c(c(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)N)C#N | |
| AKOS005250754 | 428.463 | C23 H16 N4 O3 S | JAMWMISONMUGOD-UHFFFAOYSA-N | InChI=1S/C23H16N4O3S/c1-27-21(23(29)30-26-27)20(28)14-31-22-18(13-24)17(15-8-4-2-5-9-15)12-19(25-22)16-10-6-3-7-11-16/h2-12H,14H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2c(c(cc(n2)c3ccccc3)c4ccccc4)C#N | |
| AKOS005250807 | 428.463 | C23 H16 N4 O3 S | AWBXUDFKWZLXRQ-UHFFFAOYSA-N | InChI=1S/C23H16N4O3S/c1-15-7-9-16(10-8-15)19-12-11-17(13-24)22(25-19)31-14-20(28)21-23(29)30-26-27(21)18-5-3-2-4-6-18/h2-12H,14H2,1H3 | Cc1ccc(cc1)c2ccc(c(n2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])C#N | |
| AKOS005253679 | 428.463 | C23 H16 N4 O3 S | XTYXAVVGSZAJKY-UHFFFAOYSA-N | InChI=1S/C23H16N4O3S/c1-13-7-9-14(10-8-13)17-12-11-16-18(24)21(31-22(16)25-17)20(28)19-23(29)30-26-27(19)15-5-3-2-4-6-15/h2-12H,1H3,(H2-,24,26,28,29) | Cc1ccc(cc1)c2ccc3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccccc5)[O-])N | |
| AKOS005253686 | 428.463 | C23 H16 N4 O3 S | IJZHWOUQQXGSGW-UHFFFAOYSA-N | InChI=1S/C23H16N4O3S/c1-13-12-16-17(24)21(31-22(16)25-18(13)14-8-4-2-5-9-14)20(28)19-23(29)30-26-27(19)15-10-6-3-7-11-15/h2-12H,1H3,(H2-,24,26,28,29) | Cc1cc2c(c(sc2nc1c3ccccc3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N | |
| AKOS005253890 | 428.463 | C23 H16 N4 O3 S | XUPFBHBYACOYIA-UHFFFAOYSA-N | InChI=1S/C23H16N4O3S/c1-27-19(23(29)30-26-27)20(28)21-18(24)17-15(13-8-4-2-5-9-13)12-16(25-22(17)31-21)14-10-6-3-7-11-14/h2-12H,1H3,(H2-,24,26,28,29) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4ccccc4)c5ccccc5)N | |
| AKOS005250430 | 444.463 | C23 H16 N4 O4 S | QOFFFCFHMSQCNP-UHFFFAOYSA-N | InChI=1S/C23H16N4O4S/c1-30-18-10-8-17(9-11-18)27-21(23(29)31-26-27)20(28)14-32-22-16(13-24)7-12-19(25-22)15-5-3-2-4-6-15/h2-12H,14H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(ccc(n3)c4ccccc4)C#N | |
| AKOS005250801 | 444.463 | C23 H16 N4 O4 S | DQTBKYPAUVHGCD-UHFFFAOYSA-N | InChI=1S/C23H16N4O4S/c1-30-18-10-7-15(8-11-18)19-12-9-16(13-24)22(25-19)32-14-20(28)21-23(29)31-26-27(21)17-5-3-2-4-6-17/h2-12H,14H2,1H3 | COc1ccc(cc1)c2ccc(c(n2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])C#N | |
| AKOS005251164 | 444.463 | C23 H16 N4 O4 S | VUUJWIWRLMMEQJ-UHFFFAOYSA-N | InChI=1S/C23H16N4O4S/c28-20(14-32-22-23(29)31-26-27(22)17-6-2-1-3-7-17)24-16-12-10-15(11-13-16)21-25-18-8-4-5-9-19(18)30-21/h1-13H,14H2,(H-,24,25,26,28,29) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)c4nc5ccccc5o4 | |
| AKOS005253710 | 444.463 | C23 H16 N4 O4 S | DJIKJRGJHUGAKW-UHFFFAOYSA-N | InChI=1S/C23H16N4O4S/c1-30-15-9-7-13(8-10-15)17-12-11-16-18(24)21(32-22(16)25-17)20(28)19-23(29)31-26-27(19)14-5-3-2-4-6-14/h2-12H,1H3,(H2-,24,26,28,29) | COc1ccc(cc1)c2ccc3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccccc5)[O-])N | |
| AKOS005253727 | 444.463 | C23 H16 N4 O4 S | JHDSRAAZFJQEBV-UHFFFAOYSA-N | InChI=1S/C23H16N4O4S/c1-30-15-9-7-14(8-10-15)27-19(23(29)31-26-27)20(28)21-18(24)16-11-12-17(25-22(16)32-21)13-5-3-2-4-6-13/h2-12H,1H3,(H2-,24,26,28,29) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4ccc(nc4s3)c5ccccc5)N | |
| AKOS005253736 | 444.463 | C23 H16 N4 O4 S | QEEOIWVPSFQKDB-UHFFFAOYSA-N | InChI=1S/C23H16N4O4S/c1-30-15-9-5-6-13(12-15)17-11-10-16-18(24)21(32-22(16)25-17)20(28)19-23(29)31-26-27(19)14-7-3-2-4-8-14/h2-12H,1H3,(H2-,24,26,28,29) | COc1cccc(c1)c2ccc3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccccc5)[O-])N | |
| AKOS005253771 | 444.463 | C23 H16 N4 O4 S | ZSUYBAYCAVGLEV-UHFFFAOYSA-N | InChI=1S/C23H16N4O4S/c1-30-17-10-6-5-9-14(17)16-12-11-15-18(24)21(32-22(15)25-16)20(28)19-23(29)31-26-27(19)13-7-3-2-4-8-13/h2-12H,1H3,(H2-,24,26,28,29) | COc1ccccc1c2ccc3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccccc5)[O-])N | |
| AKOS005250217 | 428.397 | C23 H16 N4 O5 | SOTRROHZQQWAJB-UHFFFAOYSA-N | InChI=1S/C23H16N4O5/c1-30-17-12-10-16(11-13-17)27-20(23(29)32-26-27)21(28)24-15-8-6-14(7-9-15)22-25-18-4-2-3-5-19(18)31-22/h2-13H,1H3,(H-,24,25,26,28,29) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3ccc(cc3)c4nc5ccccc5o4 | |
| AKOS005253781 | 460.462 | C23 H16 N4 O5 S | BGSGZZBFFYCYPP-UHFFFAOYSA-N | InChI=1S/C23H16N4O5S/c1-11-15(12(2)28)16(14-9-6-10-31-14)17-18(24)21(33-22(17)25-11)20(29)19-23(30)32-26-27(19)13-7-4-3-5-8-13/h3-10H,1-2H3,(H2-,24,26,29,30) | Cc1c(c(c2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccccc4)[O-])N)c5ccco5)C(=O)C | |
| AKOS005252518 | 427.478 | C23 H17 N5 O2 S | KDDXTETYNFGKKU-UHFFFAOYSA-N | InChI=1S/C23H17N5O2S/c1-28-14-22(30-27-28)26-21(29)15-31-23-19(13-24)18(16-8-4-2-5-9-16)12-20(25-23)17-10-6-3-7-11-17/h2-12,14H,15H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4ccccc4)C#N | |
| AKOS005251573 | 491.542 | C23 H17 N5 O4 S2 | IBPWEVGZPTXUJQ-UHFFFAOYSA-N | InChI=1S/C23H17N5O4S2/c1-14-17(12-24)21(34-19(14)20(30)25-15-8-4-2-5-9-15)26-18(29)13-33-22-23(31)32-27-28(22)16-10-6-3-7-11-16/h2-11H,13H2,1H3,(H2-,25,26,27,29,30,31) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])C#N | |
| AKOS005250212 | 475.477 | C23 H17 N5 O5 S | SARBCDJZSKUWLH-UHFFFAOYSA-N | InChI=1S/C23H17N5O5S/c1-13-17(12-24)22(34-19(13)21(30)25-14-6-4-3-5-7-14)26-20(29)18-23(31)33-27-28(18)15-8-10-16(32-2)11-9-15/h3-11H,1-2H3,(H2-,25,26,27,29,30,31) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])C#N | |
| AKOS005253238 | 471.491 | C23 H17 N7 O3 S | NUZQEMZPWAFSNO-UHFFFAOYSA-N | InChI=1S/C23H17N7O3S/c1-12(21(31)27-15-8-7-13-5-3-4-6-14(13)9-15)34-22-17(11-25)18(16(10-24)20(26)28-22)19-23(32)33-29-30(19)2/h3-9,12H,1-2H3,(H3-,26,27,28,29,31,32) | CC(C(=O)Nc1ccc2ccccc2c1)Sc3c(c(c(c(n3)N)C#N)c4c(on[n+]4C)[O-])C#N | |
| AKOS005253239 | 471.491 | C23 H17 N7 O3 S | YXZQXHZTOGDCTJ-UHFFFAOYSA-N | InChI=1S/C23H17N7O3S/c1-12(21(31)27-17-9-5-7-13-6-3-4-8-14(13)17)34-22-16(11-25)18(15(10-24)20(26)28-22)19-23(32)33-29-30(19)2/h3-9,12H,1-2H3,(H3-,26,27,28,29,31,32) | CC(C(=O)Nc1cccc2c1cccc2)Sc3c(c(c(c(n3)N)C#N)c4c(on[n+]4C)[O-])C#N | |
| AKOS005251251 | 430.479 | C23 H18 N4 O3 S | MTELJLFUMPUSKI-UHFFFAOYSA-N | InChI=1S/C23H18N4O3S/c1-25(15-19-22(28)30-24-27(19)16-9-3-2-4-10-16)23(29)26-17-11-5-7-13-20(17)31-21-14-8-6-12-18(21)26/h2-14H,15H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C(=O)N3c4ccccc4Sc5c3cccc5 | |
| AKOS005250714 | 446.478 | C23 H18 N4 O4 S | YLIYEHAAGDJCAZ-DWRJGLHPSA-N | InChI=1S/C23H18N4O4S/c1-26-20(22(30)31-25-26)19(28)15-32-23-24-18(14-8-11-16-9-4-2-5-10-16)21(29)27(23)17-12-6-3-7-13-17/h2-14H,15H2,1H3/b11-8+,18-14+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/C=C/c3ccccc3)/C(=O)N2c4ccccc4 | |
| AKOS005251015 | 446.478 | C23 H18 N4 O4 S | XAFPANOFEGGGHC-UHFFFAOYSA-O | InChI=1S/C23H17N4O4S/c28-21(16-8-3-1-4-9-16)25-19(22(29)24-15-18-12-7-13-32-18)14-20-23(30)31-26-27(20)17-10-5-2-6-11-17/h1-14H,15H2,(H,24,29)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCc4cccs4 | |
| AKOS005251058 | 430.413 | C23 H18 N4 O5 | YZNPRMWUIHOOEL-UHFFFAOYSA-O | InChI=1S/C23H17N4O5/c28-21(16-8-3-1-4-9-16)25-19(22(29)24-15-18-12-7-13-31-18)14-20-23(30)32-26-27(20)17-10-5-2-6-11-17/h1-14H,15H2,(H,24,29)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCc4ccco4 | |
| AKOS005250107 | 442.427 | C23 H18 N6 O4 | XKBQBMBJBJIEGX-UHFFFAOYSA-N | InChI=1S/C23H18N6O4/c1-13-18-19(20-23(30)33-27-28(20)15-8-10-16(31-2)11-9-15)17(12-24)21(25)32-22(18)29(26-13)14-6-4-3-5-7-14/h3-11,19H,25H2,1-2H3 | Cc1c2c(n(n1)c3ccccc3)OC(=C(C2c4c(on[n+]4c5ccc(cc5)OC)[O-])C#N)N | |
| AKOS005252855 | 499.945 | C23 H19 Cl F N5 O3 S | VPRGBSHDXACMNJ-ODLFYWEKSA-N | InChI=1S/C23H19ClFN5O3S/c1-14(2)29-12-21(33-28-29)27-20(31)13-34-23-26-19(11-16-17(24)9-6-10-18(16)25)22(32)30(23)15-7-4-3-5-8-15/h3-12,14H,13H2,1-2H3/b19-11- | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C\c3c(cccc3Cl)F)/C(=O)N2c4ccccc4 | |
| AKOS005253355 | 515.944 | C23 H19 Cl F N5 O4 S | KHNKDTXSAHLUTJ-UNOMPAQXSA-N | InChI=1S/C23H19ClFN5O4S/c1-33-11-10-29-13-21(34-28-29)27-20(31)14-35-23-26-19(12-16-17(24)8-5-9-18(16)25)22(32)30(23)15-6-3-2-4-7-15/h2-9,12-13H,10-11,14H2,1H3/b19-12- | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C\c3c(cccc3Cl)F)/C(=O)N2c4ccccc4 | |
| AKOS005252838 | 516.4 | C23 H19 Cl2 N5 O3 S | ZTASFEKZJDNZOU-VXLYETTFSA-N | InChI=1S/C23H19Cl2N5O3S/c1-14(2)29-12-21(33-28-29)27-20(31)13-34-23-26-19(10-15-8-9-16(24)11-18(15)25)22(32)30(23)17-6-4-3-5-7-17/h3-12,14H,13H2,1-2H3/b19-10+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252839 | 516.4 | C23 H19 Cl2 N5 O3 S | DYJSJDARLSGYOO-ODLFYWEKSA-N | InChI=1S/C23H19Cl2N5O3S/c1-14(2)29-12-21(33-28-29)27-20(31)13-34-23-26-19(11-16-17(24)9-6-10-18(16)25)22(32)30(23)15-7-4-3-5-8-15/h3-12,14H,13H2,1-2H3/b19-11- | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C\c3c(cccc3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252906 | 516.4 | C23 H19 Cl2 N5 O3 S | DNAMEJXNSADKSP-WOJGMQOQSA-N | InChI=1S/C23H19Cl2N5O3S/c1-14(2)29-12-20(33-28-29)27-19(31)13-34-23-26-18(11-15-7-6-10-17(24)21(15)25)22(32)30(23)16-8-4-3-5-9-16/h3-12,14H,13H2,1-2H3/b18-11+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005253372 | 532.399 | C23 H19 Cl2 N5 O4 S | IWEQLVOYPKUQHB-LDADJPATSA-N | InChI=1S/C23H19Cl2N5O4S/c1-33-11-10-29-13-20(34-28-29)27-19(31)14-35-23-26-18(12-15-6-5-9-17(24)21(15)25)22(32)30(23)16-7-3-2-4-8-16/h2-9,12-13H,10-11,14H2,1H3/b18-12+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005253380 | 532.399 | C23 H19 Cl2 N5 O4 S | YQRFEBVMEYAMRN-YBFXNURJSA-N | InChI=1S/C23H19Cl2N5O4S/c1-33-10-9-29-13-21(34-28-29)27-20(31)14-35-23-26-19(11-15-7-8-16(24)12-18(15)25)22(32)30(23)17-5-3-2-4-6-17/h2-8,11-13H,9-10,14H2,1H3/b19-11+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005253381 | 532.399 | C23 H19 Cl2 N5 O4 S | RWSGNMXEYLDCKT-UNOMPAQXSA-N | InChI=1S/C23H19Cl2N5O4S/c1-33-11-10-29-13-21(34-28-29)27-20(31)14-35-23-26-19(12-16-17(24)8-5-9-18(16)25)22(32)30(23)15-6-3-2-4-7-15/h2-9,12-13H,10-11,14H2,1H3/b19-12- | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C\c3c(cccc3Cl)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005250309 | 385.415 | C23 H19 N3 O3 | JPDJIAGCZJUOFC-UHFFFAOYSA-N | InChI=1S/C23H19N3O3/c27-22(18-11-10-16-6-4-5-7-17(16)14-18)25(19-12-13-19)15-21-23(28)29-24-26(21)20-8-2-1-3-9-20/h1-11,14,19H,12-13,15H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4ccc5ccccc5c4 | |
| AKOS005251884 | 433.48 | C23 H19 N3 O4 S | YCXPUXDWJQTKAP-UHFFFAOYSA-N | InChI=1S/C23H19N3O4S/c1-16(31-22-23(28)30-25-26(22)18-8-4-2-5-9-18)21(27)24-17-12-14-20(15-13-17)29-19-10-6-3-7-11-19/h2-16H,1H3,(H-,24,25,27,28) | CC(C(=O)Nc1ccc(cc1)Oc2ccccc2)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252250 | 433.48 | C23 H19 N3 O4 S | PPGYWIDFXJWFFU-UHFFFAOYSA-N | InChI=1S/C23H19N3O4S/c27-21(24-17-11-13-20(14-12-17)29-19-9-5-2-6-10-19)15-16-31-22-23(28)30-25-26(22)18-7-3-1-4-8-18/h1-14H,15-16H2,(H-,24,25,27,28) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)Oc4ccccc4 | |
| AKOS005251547 | 449.479 | C23 H19 N3 O5 S | XWPBGSNBTAGQGB-UHFFFAOYSA-N | InChI=1S/C23H19N3O5S/c1-29-18-13-9-17(10-14-18)26-22(23(28)31-25-26)32-15-21(27)24-16-7-11-20(12-8-16)30-19-5-3-2-4-6-19/h2-14H,15H2,1H3,(H-,24,25,27,28) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)Oc4ccccc4 | |
| AKOS005252419 | 445.494 | C23 H19 N5 O3 S | ZHJJZAJXXOIAOO-SFRRXYARSA-N | InChI=1S/C23H19N5O3S/c1-27-15-21(31-26-27)25-20(29)16-32-23-24-19(14-8-11-17-9-4-2-5-10-17)22(30)28(23)18-12-6-3-7-13-18/h2-15H,16H2,1H3/b11-8+,19-14+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/C=C/c3ccccc3)/C(=O)N2c4ccccc4 | |
| AKOS005252806 | 477.492 | C23 H19 N5 O5 S | NYUPJSYPSYGYSZ-LICLKQGHSA-N | InChI=1S/C23H19N5O5S/c1-2-27-12-21(33-26-27)25-20(29)13-34-23-24-17(22(30)28(23)16-6-4-3-5-7-16)10-15-8-9-18-19(11-15)32-14-31-18/h3-12H,2,13-14H2,1H3/b17-10+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc4c(c3)OCO4)/C(=O)N2c5ccccc5 | |
| AKOS005252777 | 526.406 | C23 H20 Br N5 O3 S | FZFGVVXTTOAHIR-XDHOZWIPSA-N | InChI=1S/C23H20BrN5O3S/c1-15(2)28-13-21(32-27-28)26-20(30)14-33-23-25-19(12-16-7-6-8-17(24)11-16)22(31)29(23)18-9-4-3-5-10-18/h3-13,15H,14H2,1-2H3/b19-12+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3)Br)/C(=O)N2c4ccccc4 | |
| AKOS005252785 | 526.406 | C23 H20 Br N5 O3 S | LXTWZJPAISCDMP-XDHOZWIPSA-N | InChI=1S/C23H20BrN5O3S/c1-15(2)28-13-21(32-27-28)26-20(30)14-33-23-25-19(12-16-8-10-17(24)11-9-16)22(31)29(23)18-6-4-3-5-7-18/h3-13,15H,14H2,1-2H3/b19-12+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)Br)/C(=O)N2c4ccccc4 | |
| AKOS005253359 | 542.405 | C23 H20 Br N5 O4 S | XIPKOEIQSMRUAO-CPNJWEJPSA-N | InChI=1S/C23H20BrN5O4S/c1-32-11-10-28-14-21(33-27-28)26-20(30)15-34-23-25-19(13-16-6-5-7-17(24)12-16)22(31)29(23)18-8-3-2-4-9-18/h2-9,12-14H,10-11,15H2,1H3/b19-13+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3)Br)/C(=O)N2c4ccccc4 | |
| AKOS005253360 | 542.405 | C23 H20 Br N5 O4 S | MUFQMHWGQSSVIZ-CPNJWEJPSA-N | InChI=1S/C23H20BrN5O4S/c1-32-12-11-28-14-21(33-27-28)26-20(30)15-34-23-25-19(13-16-7-9-17(24)10-8-16)22(31)29(23)18-5-3-2-4-6-18/h2-10,13-14H,11-12,15H2,1H3/b19-13+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)Br)/C(=O)N2c4ccccc4 | |
| AKOS005252856 | 481.955 | C23 H20 Cl N5 O3 S | YQALQTSYHYDNMR-XDHOZWIPSA-N | InChI=1S/C23H20ClN5O3S/c1-15(2)28-13-21(32-27-28)26-20(30)14-33-23-25-19(12-16-8-6-7-11-18(16)24)22(31)29(23)17-9-4-3-5-10-17/h3-13,15H,14H2,1-2H3/b19-12+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252881 | 481.955 | C23 H20 Cl N5 O3 S | DOLQMXCZMFQNSQ-XDHOZWIPSA-N | InChI=1S/C23H20ClN5O3S/c1-15(2)28-13-21(32-27-28)26-20(30)14-33-23-25-19(12-16-7-6-8-17(24)11-16)22(31)29(23)18-9-4-3-5-10-18/h3-13,15H,14H2,1-2H3/b19-12+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252882 | 481.955 | C23 H20 Cl N5 O3 S | ASQNYKIORHHORM-XDHOZWIPSA-N | InChI=1S/C23H20ClN5O3S/c1-15(2)28-13-21(32-27-28)26-20(30)14-33-23-25-19(12-16-8-10-17(24)11-9-16)22(31)29(23)18-6-4-3-5-7-18/h3-13,15H,14H2,1-2H3/b19-12+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005253356 | 497.954 | C23 H20 Cl N5 O4 S | WWOGIKCKVMHPPW-CPNJWEJPSA-N | InChI=1S/C23H20ClN5O4S/c1-32-12-11-28-14-21(33-27-28)26-20(30)15-34-23-25-19(13-16-7-5-6-10-18(16)24)22(31)29(23)17-8-3-2-4-9-17/h2-10,13-14H,11-12,15H2,1H3/b19-13+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3Cl)/C(=O)N2c4ccccc4 | |
| AKOS005253363 | 497.954 | C23 H20 Cl N5 O4 S | TYZAJAORAUUANO-CPNJWEJPSA-N | InChI=1S/C23H20ClN5O4S/c1-32-11-10-28-14-21(33-27-28)26-20(30)15-34-23-25-19(13-16-6-5-7-17(24)12-16)22(31)29(23)18-8-3-2-4-9-18/h2-9,12-14H,10-11,15H2,1H3/b19-13+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005253364 | 497.954 | C23 H20 Cl N5 O4 S | LWHCARGBPNIOTN-CPNJWEJPSA-N | InChI=1S/C23H20ClN5O4S/c1-32-12-11-28-14-21(33-27-28)26-20(30)15-34-23-25-19(13-16-7-9-17(24)10-8-16)22(31)29(23)18-5-3-2-4-6-18/h2-10,13-14H,11-12,15H2,1H3/b19-13+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)Cl)/C(=O)N2c4ccccc4 | |
| AKOS005252772 | 465.5 | C23 H20 F N5 O3 S | YOBIBOVGANUTTJ-XDHOZWIPSA-N | InChI=1S/C23H20FN5O3S/c1-15(2)28-13-21(32-27-28)26-20(30)14-33-23-25-19(12-16-8-6-7-11-18(16)24)22(31)29(23)17-9-4-3-5-10-17/h3-13,15H,14H2,1-2H3/b19-12+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3F)/C(=O)N2c4ccccc4 | |
| AKOS005252773 | 465.5 | C23 H20 F N5 O3 S | ASTSJKQAYOZFNI-XDHOZWIPSA-N | InChI=1S/C23H20FN5O3S/c1-15(2)28-13-21(32-27-28)26-20(30)14-33-23-25-19(12-16-8-10-17(24)11-9-16)22(31)29(23)18-6-4-3-5-7-18/h3-13,15H,14H2,1-2H3/b19-12+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)F)/C(=O)N2c4ccccc4 | |
| AKOS005253357 | 481.499 | C23 H20 F N5 O4 S | ZKMITAXFZLDMEI-CPNJWEJPSA-N | InChI=1S/C23H20FN5O4S/c1-32-12-11-28-14-21(33-27-28)26-20(30)15-34-23-25-19(13-16-7-5-6-10-18(16)24)22(31)29(23)17-8-3-2-4-9-17/h2-10,13-14H,11-12,15H2,1H3/b19-13+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3F)/C(=O)N2c4ccccc4 | |
| AKOS005253358 | 481.499 | C23 H20 F N5 O4 S | JDCRINGGBAMQPY-CPNJWEJPSA-N | InChI=1S/C23H20FN5O4S/c1-32-12-11-28-14-21(33-27-28)26-20(30)15-34-23-25-19(13-16-7-9-17(24)10-8-16)22(31)29(23)18-5-3-2-4-6-18/h2-10,13-14H,11-12,15H2,1H3/b19-13+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)F)/C(=O)N2c4ccccc4 | |
| AKOS005253823 | 535.496 | C23 H20 F3 N5 O5 S | RJLGOBOVVIZJHU-UHFFFAOYSA-N | InChI=1S/C23H20F3N5O5S/c1-13-3-7-15(8-4-13)31-20(33)17(30(22(31)37)12-18-21(34)36-28-29(18)2)11-19(32)27-14-5-9-16(10-6-14)35-23(24,25)26/h3-10,17H,11-12H2,1-2H3,(H-,27,28,32,34) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)OC(F)(F)F | |
| AKOS005219838 | 416.496 | C23 H20 N4 O2 S | KDEPHAVIJLDVMF-UHFFFAOYSA-N | InChI=1S/C23H20N4O2S/c28-22-21(27(25-29-22)20-14-8-3-9-15-20)17-26(16-18-10-4-1-5-11-18)23(30)24-19-12-6-2-7-13-19/h1-15H,16-17H2,(H-,24,25,28,30) | c1ccc(cc1)CN(Cc2c(on[n+]2c3ccccc3)[O-])C(=S)Nc4ccccc4 | |
| AKOS005250732 | 464.494 | C23 H20 N4 O5 S | XSJUSZCGXGLOJX-GHRIWEEISA-N | InChI=1S/C23H20N4O5S/c1-3-31-19-12-8-7-9-15(19)13-17-21(29)27(16-10-5-4-6-11-16)23(24-17)33-14-18(28)20-22(30)32-25-26(20)2/h4-13H,3,14H2,1-2H3/b17-13+ | CCOc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3C)[O-])c4ccccc4 | |
| AKOS005250752 | 464.494 | C23 H20 N4 O5 S | WUYOXPCBAUQVQD-QGOAFFKASA-N | InChI=1S/C23H20N4O5S/c1-3-31-17-11-9-15(10-12-17)13-18-21(29)27(16-7-5-4-6-8-16)23(24-18)33-14-19(28)20-22(30)32-25-26(20)2/h4-13H,3,14H2,1-2H3/b18-13+ | CCOc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3C)[O-])c4ccccc4 | |
| AKOS005250685 | 480.493 | C23 H20 N4 O6 S | PWCMXZVVABJEFB-LFIBNONCSA-N | InChI=1S/C23H20N4O6S/c1-26-20(22(30)33-25-26)17(28)13-34-23-24-16(21(29)27(23)15-7-5-4-6-8-15)11-14-9-10-18(31-2)19(12-14)32-3/h4-12H,13H2,1-3H3/b16-11+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3ccc(c(c3)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005250744 | 480.493 | C23 H20 N4 O6 S | UMHVECIKDUCJMQ-FOWTUZBSSA-N | InChI=1S/C23H20N4O6S/c1-26-19(22(30)33-25-26)17(28)13-34-23-24-16(21(29)27(23)15-9-5-4-6-10-15)12-14-8-7-11-18(31-2)20(14)32-3/h4-12H,13H2,1-3H3/b16-12+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3cccc(c3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005250750 | 480.493 | C23 H20 N4 O6 S | ACBRSMBFCOYLFI-GZTJUZNOSA-N | InChI=1S/C23H20N4O6S/c1-26-20(22(30)33-25-26)18(28)13-34-23-24-17(21(29)27(23)15-7-5-4-6-8-15)11-14-9-10-16(31-2)12-19(14)32-3/h4-12H,13H2,1-3H3/b17-11+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3ccc(cc3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005250751 | 480.493 | C23 H20 N4 O6 S | ZJNHGIGNKWTFCD-SFQUDFHCSA-N | InChI=1S/C23H20N4O6S/c1-26-20(22(30)33-25-26)18(28)13-34-23-24-17(21(29)27(23)15-7-5-4-6-8-15)12-14-11-16(31-2)9-10-19(14)32-3/h4-12H,13H2,1-3H3/b17-12+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3cc(ccc3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252742 | 492.507 | C23 H20 N6 O5 S | MQLKEQKTUQSCOR-LICLKQGHSA-N | InChI=1S/C23H20N6O5S/c1-27(2)28-12-21(34-26-28)25-20(30)13-35-23-24-17(22(31)29(23)16-6-4-3-5-7-16)10-15-8-9-18-19(11-15)33-14-32-18/h3-12H,13-14H2,1-2H3/b17-10+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc4c(c3)OCO4)/C(=O)N2c5ccccc5 | |
| AKOS005253498 | 492.507 | C23 H20 N6 O5 S | OMEHYJXTAVUEDM-UHFFFAOYSA-N | InChI=1S/C23H20N6O5S/c1-27-21(31)16(29(23(27)35)12-17-22(32)34-26-28(17)2)11-19(30)24-14-9-7-13(8-10-14)20-25-15-5-3-4-6-18(15)33-20/h3-10,16H,11-12H2,1-2H3,(H-,24,25,26,30,32) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C)CC(=O)Nc3ccc(cc3)c4nc5ccccc5o4 | |
| AKOS005251380 | 513.341 | C23 H21 Br N4 O5 | JSOWGPPNMGTVLI-UHFFFAOYSA-N | InChI=1S/C23H21BrN4O5/c1-32-18-10-8-17(9-11-18)28-20(23(31)33-25-28)13-26(15-6-7-15)19-12-21(29)27(22(19)30)16-4-2-14(24)3-5-16/h2-5,8-11,15,19H,6-7,12-13H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C4CC(=O)N(C4=O)c5ccc(cc5)Br | |
| AKOS005253938 | 557.42 | C23 H21 Br N6 O4 S | SGIOYRZOKIGSSQ-UHFFFAOYSA-N | InChI=1S/C23H21BrN6O4S/c1-28-22(33)17(12-19(31)25-16-10-8-15(24)9-11-16)30(23(28)35)13-18-21(34-27-29(18)2)26-20(32)14-6-4-3-5-7-14/h3-11,17H,12-13H2,1-2H3,(H-,25,26,27,31,32) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)Br | |
| AKOS005251372 | 468.89 | C23 H21 Cl N4 O5 | GMESGFIHYUGPGL-UHFFFAOYSA-N | InChI=1S/C23H21ClN4O5/c1-32-18-10-8-17(9-11-18)28-20(23(31)33-25-28)13-26(15-6-7-15)19-12-21(29)27(22(19)30)16-4-2-14(24)3-5-16/h2-5,8-11,15,19H,6-7,12-13H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C4CC(=O)N(C4=O)c5ccc(cc5)Cl | |
| AKOS005253937 | 512.969 | C23 H21 Cl N6 O4 S | UQFIDXNFOVWFJH-UHFFFAOYSA-N | InChI=1S/C23H21ClN6O4S/c1-28-22(33)17(12-19(31)25-16-10-8-15(24)9-11-16)30(23(28)35)13-18-21(34-27-29(18)2)26-20(32)14-6-4-3-5-7-14/h3-11,17H,12-13H2,1-2H3,(H-,25,26,27,31,32) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)Cl | |
| AKOS005251373 | 452.435 | C23 H21 F N4 O5 | UKCOMYCBKBUFFF-UHFFFAOYSA-N | InChI=1S/C23H21FN4O5/c1-32-18-10-8-17(9-11-18)28-20(23(31)33-25-28)13-26(15-6-7-15)19-12-21(29)27(22(19)30)16-4-2-14(24)3-5-16/h2-5,8-11,15,19H,6-7,12-13H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C4CC(=O)N(C4=O)c5ccc(cc5)F | |
| AKOS005254038 | 496.514 | C23 H21 F N6 O4 S | DRCYHPCBBODPHG-UHFFFAOYSA-N | InChI=1S/C23H21FN6O4S/c1-28-22(33)17(12-19(31)25-16-10-8-15(24)9-11-16)30(23(28)35)13-18-21(34-27-29(18)2)26-20(32)14-6-4-3-5-7-14/h3-11,17H,12-13H2,1-2H3,(H-,25,26,27,31,32) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)F | |
| AKOS005253602 | 522.431 | C23 H21 F3 N4 O7 | UDYGNZVIKJIZBF-UHFFFAOYSA-N | InChI=1S/C23H21F3N4O7/c1-34-16-8-4-15(5-9-16)30-18(22(33)37-28-30)13-29-10-11-35-19(21(29)32)12-20(31)27-14-2-6-17(7-3-14)36-23(24,25)26/h2-9,19H,10-13H2,1H3,(H-,27,28,31,33) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)OC(F)(F)F | |
| AKOS005253132 | 518.511 | C23 H21 F3 N6 O3 S | XFUPNQXQSRFEIQ-UHFFFAOYSA-N | InChI=1S/C23H21F3N6O3S/c1-34-16-7-5-15(6-8-16)19-11-18(23(24,25)26)17(12-27)22(28-19)36-14-20(33)29-21-13-32(30-35-21)31-9-3-2-4-10-31/h5-8,11,13H,2-4,9-10,14H2,1H3 | COc1ccc(cc1)c2cc(c(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)C#N)C(F)(F)F | |
| AKOS005254037 | 604.42 | C23 H21 I N6 O4 S | XCZRHGVJROESSP-UHFFFAOYSA-N | InChI=1S/C23H21IN6O4S/c1-28-22(33)17(12-19(31)25-16-10-8-15(24)9-11-16)30(23(28)35)13-18-21(34-27-29(18)2)26-20(32)14-6-4-3-5-7-14/h3-11,17H,12-13H2,1-2H3,(H-,25,26,27,31,32) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)I | |
| AKOS005252045 | 435.496 | C23 H21 N3 O4 S | GWZQCSPNHMFREF-UHFFFAOYSA-N | InChI=1S/C23H21N3O4S/c1-3-20(21(27)24-19-10-6-8-15-7-4-5-9-18(15)19)31-22-23(28)30-25-26(22)16-11-13-17(29-2)14-12-16/h4-14,20H,3H2,1-2H3,(H-,24,25,27,28) | CCC(C(=O)Nc1cccc2c1cccc2)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252100 | 435.496 | C23 H21 N3 O4 S | FRSUWWVNMZVXDD-UHFFFAOYSA-N | InChI=1S/C23H21N3O4S/c1-3-20(21(27)24-17-9-8-15-6-4-5-7-16(15)14-17)31-22-23(28)30-25-26(22)18-10-12-19(29-2)13-11-18/h4-14,20H,3H2,1-2H3,(H-,24,25,27,28) | CCC(C(=O)Nc1ccc2ccccc2c1)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252786 | 447.51 | C23 H21 N5 O3 S | ZKUWUGZUVVMUNG-CPNJWEJPSA-N | InChI=1S/C23H21N5O3S/c1-16(2)27-14-21(31-26-27)25-20(29)15-32-23-24-19(13-17-9-5-3-6-10-17)22(30)28(23)18-11-7-4-8-12-18/h3-14,16H,15H2,1-2H3/b19-13+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3)/C(=O)N2c4ccccc4 | |
| AKOS005252811 | 447.51 | C23 H21 N5 O3 S | DZAZWPHYVWUARQ-CPNJWEJPSA-N | InChI=1S/C23H21N5O3S/c1-3-27-14-21(31-26-27)25-20(29)15-32-23-24-19(13-17-10-8-7-9-16(17)2)22(30)28(23)18-11-5-4-6-12-18/h4-14H,3,15H2,1-2H3/b19-13+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3C)/C(=O)N2c4ccccc4 | |
| AKOS005252812 | 447.51 | C23 H21 N5 O3 S | QQDIEIUVPSJYSG-CPNJWEJPSA-N | InChI=1S/C23H21N5O3S/c1-3-27-14-21(31-26-27)25-20(29)15-32-23-24-19(13-17-9-7-8-16(2)12-17)22(30)28(23)18-10-5-4-6-11-18/h4-14H,3,15H2,1-2H3/b19-13+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3)C)/C(=O)N2c4ccccc4 | |
| AKOS005252813 | 447.51 | C23 H21 N5 O3 S | AYDWVFKNGOUWBR-CPNJWEJPSA-N | InChI=1S/C23H21N5O3S/c1-3-27-14-21(31-26-27)25-20(29)15-32-23-24-19(13-17-11-9-16(2)10-12-17)22(30)28(23)18-7-5-4-6-8-18/h4-14H,3,15H2,1-2H3/b19-13+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)C)/C(=O)N2c4ccccc4 | |
| AKOS005250938 | 431.444 | C23 H21 N5 O4 | XKGQEYWXFRRTEY-UHFFFAOYSA-O | InChI=1S/C23H20N5O4/c1-28-20(23(31)32-27-28)13-19(26-21(29)15-7-3-2-4-8-15)22(30)24-12-11-16-14-25-18-10-6-5-9-17(16)18/h2-10,13-14,25H,11-12H2,1H3,(H,24,30)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCc2c[nH]c3c2cccc3)\NC(=O)c4ccccc4 | |
| AKOS005250686 | 463.509 | C23 H21 N5 O4 S | WRCKEPAEMNVXSK-QGOAFFKASA-N | InChI=1S/C23H21N5O4S/c1-26(2)16-11-9-15(10-12-16)13-18-21(30)28(17-7-5-4-6-8-17)23(24-18)33-14-19(29)20-22(31)32-25-27(20)3/h4-13H,14H2,1-3H3/b18-13+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3ccc(cc3)N(C)C)/C(=O)N2c4ccccc4 | |
| AKOS005252459 | 463.509 | C23 H21 N5 O4 S | MHSKUGQWIUYENF-QGOAFFKASA-N | InChI=1S/C23H21N5O4S/c1-3-31-19-12-8-7-9-16(19)13-18-22(30)28(17-10-5-4-6-11-17)23(24-18)33-15-20(29)25-21-14-27(2)26-32-21/h4-14H,3,15H2,1-2H3/b18-13+ | CCOc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)C)c4ccccc4 | |
| AKOS005252466 | 463.509 | C23 H21 N5 O4 S | IQFMIJFQULGYKR-CPNJWEJPSA-N | InChI=1S/C23H21N5O4S/c1-3-31-18-11-9-16(10-12-18)13-19-22(30)28(17-7-5-4-6-8-17)23(24-19)33-15-20(29)25-21-14-27(2)26-32-21/h4-14H,3,15H2,1-2H3/b19-13+ | CCOc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)C)c4ccccc4 | |
| AKOS005252802 | 463.509 | C23 H21 N5 O4 S | GLMXLOCXBVFSPP-CPNJWEJPSA-N | InChI=1S/C23H21N5O4S/c1-3-27-14-21(32-26-27)25-20(29)15-33-23-24-19(13-16-9-11-18(31-2)12-10-16)22(30)28(23)17-7-5-4-6-8-17/h4-14H,3,15H2,1-2H3/b19-13+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252803 | 463.509 | C23 H21 N5 O4 S | AUTUFYXIGMSNPY-QGOAFFKASA-N | InChI=1S/C23H21N5O4S/c1-3-27-14-21(32-26-27)25-20(29)15-33-23-24-18(13-16-9-7-8-12-19(16)31-2)22(30)28(23)17-10-5-4-6-11-17/h4-14H,3,15H2,1-2H3/b18-13+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3OC)/C(=O)N2c4ccccc4 | |
| AKOS005252913 | 463.509 | C23 H21 N5 O4 S | CASNEHFRKGHJMC-CPNJWEJPSA-N | InChI=1S/C23H21N5O4S/c1-3-27-14-21(32-26-27)25-20(29)15-33-23-24-19(13-16-8-7-11-18(12-16)31-2)22(30)28(23)17-9-5-4-6-10-17/h4-14H,3,15H2,1-2H3/b19-13+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253367 | 463.509 | C23 H21 N5 O4 S | PDULIJKZKXLJKU-XMHGGMMESA-N | InChI=1S/C23H21N5O4S/c1-31-13-12-27-15-21(32-26-27)25-20(29)16-33-23-24-19(14-17-8-4-2-5-9-17)22(30)28(23)18-10-6-3-7-11-18/h2-11,14-15H,12-13,16H2,1H3/b19-14+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3)/C(=O)N2c4ccccc4 | |
| AKOS005251370 | 447.443 | C23 H21 N5 O5 | FRKJTSAVMJDPIN-UHFFFAOYSA-N | InChI=1S/C23H21N5O5/c24-21(30)14-6-8-16(9-7-14)27-20(29)12-18(22(27)31)26(15-10-11-15)13-19-23(32)33-25-28(19)17-4-2-1-3-5-17/h1-9,15,18H,10-13H2,(H2-,24,25,30,32) | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C4CC(=O)N(C4=O)c5ccc(cc5)C(=O)N | |
| AKOS005252428 | 479.508 | C23 H21 N5 O5 S | RHOBZUBKEKBYBH-SFQUDFHCSA-N | InChI=1S/C23H21N5O5S/c1-27-13-20(33-26-27)25-19(29)14-34-23-24-17(22(30)28(23)16-9-5-4-6-10-16)12-15-8-7-11-18(31-2)21(15)32-3/h4-13H,14H2,1-3H3/b17-12+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252431 | 479.508 | C23 H21 N5 O5 S | DPLIDVLKKDGKAO-WOJGMQOQSA-N | InChI=1S/C23H21N5O5S/c1-27-13-21(33-26-27)25-20(29)14-34-23-24-18(22(30)28(23)16-7-5-4-6-8-16)11-15-9-10-17(31-2)12-19(15)32-3/h4-13H,14H2,1-3H3/b18-11+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252432 | 479.508 | C23 H21 N5 O5 S | YPJLZVRQZZVUMW-LDADJPATSA-N | InChI=1S/C23H21N5O5S/c1-27-13-21(33-26-27)25-20(29)14-34-23-24-18(22(30)28(23)16-7-5-4-6-8-16)12-15-11-17(31-2)9-10-19(15)32-3/h4-13H,14H2,1-3H3/b18-12+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cc(ccc3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252440 | 479.508 | C23 H21 N5 O5 S | PFXUKXXJAJYJQE-GZTJUZNOSA-N | InChI=1S/C23H21N5O5S/c1-27-13-21(33-26-27)25-20(29)14-34-23-24-17(22(30)28(23)16-7-5-4-6-8-16)11-15-9-10-18(31-2)19(12-15)32-3/h4-13H,14H2,1-3H3/b17-11+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(c(c3)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253932 | 479.508 | C23 H21 N5 O5 S | MFGMLGSWJKAORB-UHFFFAOYSA-N | InChI=1S/C23H21N5O5S/c1-14(29)15-8-10-16(11-9-15)24-20(30)12-18-21(31)28(17-6-4-3-5-7-17)23(34)27(18)13-19-22(32)33-25-26(19)2/h3-11,18H,12-13H2,1-2H3,(H-,24,25,29,30,32) | CC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])c4ccccc4 | |
| AKOS005253621 | 463.443 | C23 H21 N5 O6 | ZPIIEOIJYMIEAO-UHFFFAOYSA-N | InChI=1S/C23H21N5O6/c1-27-17(23(31)34-26-27)13-28-10-11-32-19(22(28)30)12-20(29)24-15-8-6-14(7-9-15)21-25-16-4-2-3-5-18(16)33-21/h2-9,19H,10-13H2,1H3,(H-,24,25,26,29,31) | C[n+]1c(c(on1)[O-])CN2CCOC(C2=O)CC(=O)Nc3ccc(cc3)c4nc5ccccc5o4 | |
| AKOS005253805 | 495.508 | C23 H21 N5 O6 S | BMEBNKLNUZQPSS-UHFFFAOYSA-N | InChI=1S/C23H21N5O6S/c1-26-18(22(32)34-25-26)13-27-17(20(30)28(23(27)35)16-6-4-3-5-7-16)12-19(29)24-15-10-8-14(9-11-15)21(31)33-2/h3-11,17H,12-13H2,1-2H3,(H-,24,25,29,31,32) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)c3ccccc3)CC(=O)Nc4ccc(cc4)C(=O)OC | |
| AKOS005251267 | 479.442 | C23 H21 N5 O7 | NLSLIAJUSLTQAO-UHFFFAOYSA-N | InChI=1S/C23H21N5O7/c1-34-18-10-8-16(9-11-18)27-20(23(31)35-24-27)13-25(14-2-3-14)19-12-21(29)26(22(19)30)15-4-6-17(7-5-15)28(32)33/h4-11,14,19H,2-3,12-13H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C4CC(=O)N(C4=O)c5ccc(cc5)[N+](=O)[O-] | |
| AKOS005252938 | 475.523 | C23 H21 N7 O3 S | OTRWTLIYLIOOKS-UHFFFAOYSA-N | InChI=1S/C23H21N7O3S/c31-19(24-20-15-30(28-33-20)29-11-13-32-14-12-29)16-34-23-25-21(17-7-3-1-4-8-17)22(26-27-23)18-9-5-2-6-10-18/h1-10,15H,11-14,16H2 | c1ccc(cc1)c2c(nnc(n2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005252960 | 491.522 | C23 H21 N7 O4 S | NOHMLCUXNROTQR-XMHGGMMESA-N | InChI=1S/C23H21N7O4S/c31-20(26-21-15-29(27-34-21)28-10-12-33-13-11-28)16-35-23-25-19(14-17-6-4-5-9-24-17)22(32)30(23)18-7-2-1-3-8-18/h1-9,14-15H,10-13,16H2/b19-14+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccccn3)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005252966 | 491.522 | C23 H21 N7 O4 S | SQWGDWTXQSXHBQ-CPNJWEJPSA-N | InChI=1S/C23H21N7O4S/c31-20(26-21-15-29(27-34-21)28-9-11-33-12-10-28)16-35-23-25-19(13-17-5-4-8-24-14-17)22(32)30(23)18-6-2-1-3-7-18/h1-8,13-15H,9-12,16H2/b19-13+ | c1ccc(cc1)N2C(=O)/C(=C\c3cccnc3)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005252967 | 491.522 | C23 H21 N7 O4 S | CUDKRKXSBXQCAX-XMHGGMMESA-N | InChI=1S/C23H21N7O4S/c31-20(26-21-15-29(27-34-21)28-10-12-33-13-11-28)16-35-23-25-19(14-17-6-8-24-9-7-17)22(32)30(23)18-4-2-1-3-5-18/h1-9,14-15H,10-13,16H2/b19-14+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccncc3)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005253495 | 507.522 | C23 H21 N7 O5 S | PQLVGVVJXZPVNG-UHFFFAOYSA-N | InChI=1S/C23H21N7O5S/c1-3-4-9-34-22(32)11-5-7-12(8-6-11)27-20(31)18-16(25)15-14(17-23(33)35-29-30(17)2)13(10-24)19(26)28-21(15)36-18/h5-8H,3-4,9H2,1-2H3,(H5-,25,26,27,28,29,31,32,33) | CCCCOC(=O)c1ccc(cc1)NC(=O)c2c(c3c(c(c(nc3s2)N)C#N)c4c(on[n+]4C)[O-])N | |
| AKOS005253630 | 507.522 | C23 H21 N7 O5 S | XKUKQBYRHHDCNK-UHFFFAOYSA-N | InChI=1S/C23H21N7O5S/c1-3-4-9-34-22(32)13-5-7-14(8-6-13)27-17(31)12-36-21-16(11-25)18(15(10-24)20(26)28-21)19-23(33)35-29-30(19)2/h5-8H,3-4,9,12H2,1-2H3,(H3-,26,27,28,29,31,32,33) | CCCCOC(=O)c1ccc(cc1)NC(=O)CSc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005254081 | 523.521 | C23 H21 N7 O6 S | RYXDOESGJZLANO-UHFFFAOYSA-N | InChI=1S/C23H21N7O6S/c1-27-22(33)17(12-19(31)24-15-8-10-16(11-9-15)30(34)35)29(23(27)37)13-18-21(36-26-28(18)2)25-20(32)14-6-4-3-5-7-14/h3-11,17H,12-13H2,1-2H3,(H-,24,25,26,31,32) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)N(=O)=O | |
| AKOS005253822 | 560.42 | C23 H22 Br N5 O5 S | KHMRSXDIGBHXLI-UHFFFAOYSA-N | InChI=1S/C23H22BrN5O5S/c1-3-33-17-10-8-16(9-11-17)29-21(31)18(12-20(30)25-15-6-4-14(24)5-7-15)28(23(29)35)13-19-22(32)34-26-27(19)2/h4-11,18H,3,12-13H2,1-2H3,(H-,25,26,30,32) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)Br | |
| AKOS005253821 | 515.969 | C23 H22 Cl N5 O5 S | UDMNLQPWIDMCPQ-UHFFFAOYSA-N | InChI=1S/C23H22ClN5O5S/c1-3-33-17-10-8-16(9-11-17)29-21(31)18(12-20(30)25-15-6-4-14(24)5-7-15)28(23(29)35)13-19-22(32)34-26-27(19)2/h4-11,18H,3,12-13H2,1-2H3,(H-,25,26,30,32) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)Cl | |
| AKOS005250940 | 451.45 | C23 H22 F N5 O4 | QULZJFXELQQAGS-UHFFFAOYSA-O | InChI=1S/C23H21FN5O4/c1-27-20(23(32)33-26-27)15-18(25-21(30)16-7-3-2-4-8-16)22(31)29-13-11-28(12-14-29)19-10-6-5-9-17(19)24/h2-10,15H,11-14H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCN(CC2)c3ccccc3F)\NC(=O)c4ccccc4 | |
| AKOS005250947 | 451.45 | C23 H22 F N5 O4 | HTYWHNXWTXWVDN-UHFFFAOYSA-O | InChI=1S/C23H21FN5O4/c1-27-20(23(32)33-26-27)15-19(25-21(30)16-5-3-2-4-6-16)22(31)29-13-11-28(12-14-29)18-9-7-17(24)8-10-18/h2-10,15H,11-14H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCN(CC2)c3ccc(cc3)F)\NC(=O)c4ccccc4 | |
| AKOS005253816 | 499.515 | C23 H22 F N5 O5 S | SOYKREUXNFJPKI-UHFFFAOYSA-N | InChI=1S/C23H22FN5O5S/c1-3-33-17-10-8-16(9-11-17)29-21(31)18(12-20(30)25-15-6-4-14(24)5-7-15)28(23(29)35)13-19-22(32)34-26-27(19)2/h4-11,18H,3,12-13H2,1-2H3,(H-,25,26,30,32) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)F | |
| AKOS005253815 | 607.421 | C23 H22 I N5 O5 S | MCAZVUOLEXVSBV-UHFFFAOYSA-N | InChI=1S/C23H22IN5O5S/c1-3-33-17-10-8-16(9-11-17)29-21(31)18(12-20(30)25-15-6-4-14(24)5-7-15)28(23(29)35)13-19-22(32)34-26-27(19)2/h4-11,18H,3,12-13H2,1-2H3,(H-,25,26,30,32) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)I | |
| AKOS005251020 | 418.445 | C23 H22 N4 O4 | HYASOQFHMFDGQC-UHFFFAOYSA-O | InChI=1S/C23H21N4O4/c28-21(16-9-3-1-4-10-16)25-19(22(29)24-17-11-7-8-12-17)15-20-23(30)31-26-27(20)18-13-5-2-6-14-18/h1-6,9-10,13-15,17H,7-8,11-12H2,(H,24,29)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NC4CCCC4 | |
| AKOS005251071 | 418.445 | C23 H22 N4 O4 | BOVLFYSMPKXYSO-UHFFFAOYSA-O | InChI=1S/C23H21N4O4/c28-21(17-10-4-1-5-11-17)24-19(22(29)26-14-8-3-9-15-26)16-20-23(30)31-25-27(20)18-12-6-2-7-13-18/h1-2,4-7,10-13,16H,3,8-9,14-15H2/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CCCCC4 | |
| AKOS005251369 | 418.445 | C23 H22 N4 O4 | PBPOYHJTGWMTNT-UHFFFAOYSA-N | InChI=1S/C23H22N4O4/c1-15-7-9-17(10-8-15)26-21(28)13-19(22(26)29)25(16-11-12-16)14-20-23(30)31-24-27(20)18-5-3-2-4-6-18/h2-10,16,19H,11-14H2,1H3 | Cc1ccc(cc1)N2C(=O)CC(C2=O)N(Cc3c(on[n+]3c4ccccc4)[O-])C5CC5 | |
| AKOS005250470 | 450.51 | C23 H22 N4 O4 S | OGCTVIRRCFXKRY-UHFFFAOYSA-N | InChI=1S/C23H22N4O4S/c1-30-18-10-8-17(9-11-18)27-21(23(29)31-26-27)20(28)14-32-22-16(13-24)12-15-6-4-2-3-5-7-19(15)25-22/h8-12H,2-7,14H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(cc4c(n3)CCCCCC4)C#N | |
| AKOS005253782 | 450.51 | C23 H22 N4 O4 S | CNBPMAGSAJDGAO-UHFFFAOYSA-N | InChI=1S/C23H22N4O4S/c1-30-15-10-8-14(9-11-15)27-19(23(29)31-26-27)20(28)21-18(24)16-12-13-6-4-2-3-5-7-17(13)25-22(16)32-21/h8-12H,2-7H2,1H3,(H2-,24,26,28,29) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4cc5c(nc4s3)CCCCCC5)N | |
| AKOS005250883 | 434.445 | C23 H22 N4 O5 | BOADYGBYTQPPBE-UHFFFAOYSA-O | InChI=1S/C23H21N4O5/c1-31-18-11-9-17(10-12-18)27-20(23(30)32-25-27)15-19(22(29)26-13-5-6-14-26)24-21(28)16-7-3-2-4-8-16/h2-4,7-12,15H,5-6,13-14H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCCC3)\NC(=O)c4ccccc4 | |
| AKOS005250967 | 434.445 | C23 H22 N4 O5 | KUWGWAPJVJGNBU-UHFFFAOYSA-O | InChI=1S/C23H21N4O5/c28-18-11-13-26(14-12-18)22(30)19(24-21(29)16-7-3-1-4-8-16)15-20-23(31)32-25-27(20)17-9-5-2-6-10-17/h1-10,15,18,28H,11-14H2/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CCC(CC4)O | |
| AKOS005251073 | 434.445 | C23 H22 N4 O5 | GZNLTZRGTSWDDZ-UHFFFAOYSA-O | InChI=1S/C23H21N4O5/c28-21(16-8-3-1-4-9-16)25-19(22(29)24-15-18-12-7-13-31-18)14-20-23(30)32-26-27(20)17-10-5-2-6-11-17/h1-6,8-11,14,18H,7,12-13,15H2,(H,24,29)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCC4CCCO4 | |
| AKOS005251253 | 434.445 | C23 H22 N4 O5 | KAQSIIJLOLWBTR-UHFFFAOYSA-N | InChI=1S/C23H22N4O5/c1-31-18-11-9-16(10-12-18)26-21(28)13-19(22(26)29)25(15-7-8-15)14-20-23(30)32-24-27(20)17-5-3-2-4-6-17/h2-6,9-12,15,19H,7-8,13-14H2,1H3 | COc1ccc(cc1)N2C(=O)CC(C2=O)N(Cc3c(on[n+]3c4ccccc4)[O-])C5CC5 | |
| AKOS005251364 | 434.445 | C23 H22 N4 O5 | UXSOQMPBVNNDGN-UHFFFAOYSA-N | InChI=1S/C23H22N4O5/c1-31-18-11-9-17(10-12-18)27-20(23(30)32-24-27)14-25(15-7-8-15)19-13-21(28)26(22(19)29)16-5-3-2-4-6-16/h2-6,9-12,15,19H,7-8,13-14H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C4CC(=O)N(C4=O)c5ccccc5 | |
| AKOS005250879 | 466.51 | C23 H22 N4 O5 S | GXHIYGTZANFFQX-UHFFFAOYSA-O | InChI=1S/C23H21N4O5S/c1-31-18-9-7-17(8-10-18)27-20(23(30)32-25-27)15-19(22(29)26-11-13-33-14-12-26)24-21(28)16-5-3-2-4-6-16/h2-10,15H,11-14H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCSCC3)\NC(=O)c4ccccc4 | |
| AKOS005250360 | 450.444 | C23 H22 N4 O6 | YIVFUHLHWXDJRP-UHFFFAOYSA-N | InChI=1S/C23H22N4O6/c1-15(28)16-7-9-17(10-8-16)24-21(29)13-20-22(30)26(11-12-32-20)14-19-23(31)33-25-27(19)18-5-3-2-4-6-18/h2-10,20H,11-14H2,1H3,(H-,24,25,28,29,31) | CC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250877 | 450.444 | C23 H22 N4 O6 | XZXAYECRZYDZOS-UHFFFAOYSA-O | InChI=1S/C23H21N4O6/c1-31-18-9-7-17(8-10-18)27-20(23(30)33-25-27)15-19(22(29)26-11-13-32-14-12-26)24-21(28)16-5-3-2-4-6-16/h2-10,15H,11-14H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCOCC3)\NC(=O)c4ccccc4 | |
| AKOS005251278 | 450.444 | C23 H22 N4 O6 | MVTMITVMZDPEQG-UHFFFAOYSA-N | InChI=1S/C23H22N4O6/c1-3-32-22(30)15-9-11-16(12-10-15)26-20(28)13-18(21(26)29)25(2)14-19-23(31)33-24-27(19)17-7-5-4-6-8-17/h4-12,18H,3,13-14H2,1-2H3 | CCOC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)N(C)Cc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251310 | 450.444 | C23 H22 N4 O6 | ABMQZOVVZIEXKV-UHFFFAOYSA-N | InChI=1S/C23H22N4O6/c1-14(28)15-4-6-16(7-5-15)26-21(29)12-19(22(26)30)25(2)13-20-23(31)33-24-27(20)17-8-10-18(32-3)11-9-17/h4-11,19H,12-13H2,1-3H3 | CC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)N(C)Cc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005253175 | 466.443 | C23 H22 N4 O7 | WQAFGPYXHBEUOO-UHFFFAOYSA-N | InChI=1S/C23H22N4O7/c1-3-33-22(30)14-4-6-15(7-5-14)26-20(28)12-18(21(26)29)24-13-19-23(31)34-25-27(19)16-8-10-17(32-2)11-9-16/h4-11,18,24H,3,12-13H2,1-2H3 | CCOC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)NCc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005253612 | 466.443 | C23 H22 N4 O7 | DZFUSZUMUIDGBH-UHFFFAOYSA-N | InChI=1S/C23H22N4O7/c1-32-22(30)15-7-9-16(10-8-15)24-20(28)13-19-21(29)26(11-12-33-19)14-18-23(31)34-25-27(18)17-5-3-2-4-6-17/h2-10,19H,11-14H2,1H3,(H-,24,25,28,30,31) | COC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005253800 | 498.508 | C23 H22 N4 O7 S | POCZZFYYQWIDQL-UHFFFAOYSA-N | InChI=1S/C23H22N4O7S/c1-9-14(10(2)28)15(11-7-12(31-4)20(33-6)13(8-11)32-5)16-17(24)21(35-22(16)25-9)19(29)18-23(30)34-26-27(18)3/h7-8H,1-6H3,(H2-,24,26,29,30) | Cc1c(c(c2c(c(sc2n1)C(=O)c3c(on[n+]3C)[O-])N)c4cc(c(c(c4)OC)OC)OC)C(=O)C | |
| AKOS005252441 | 462.524 | C23 H22 N6 O3 S | XDOSLVGHPJNTOU-CPNJWEJPSA-N | InChI=1S/C23H22N6O3S/c1-27(2)17-11-9-16(10-12-17)13-19-22(31)29(18-7-5-4-6-8-18)23(24-19)33-15-20(30)25-21-14-28(3)26-32-21/h4-14H,15H2,1-3H3/b19-13+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)N(C)C)/C(=O)N2c4ccccc4 | |
| AKOS005252704 | 462.524 | C23 H22 N6 O3 S | SEKBKSXDYBPOOS-CPNJWEJPSA-N | InChI=1S/C23H22N6O3S/c1-16-9-7-8-10-17(16)13-19-22(31)29(18-11-5-4-6-12-18)23(24-19)33-15-20(30)25-21-14-28(26-32-21)27(2)3/h4-14H,15H2,1-3H3/b19-13+ | Cc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N(C)C)c4ccccc4 | |
| AKOS005252734 | 462.524 | C23 H22 N6 O3 S | GCSACFYKXULERA-CPNJWEJPSA-N | InChI=1S/C23H22N6O3S/c1-16-8-7-9-17(12-16)13-19-22(31)29(18-10-5-4-6-11-18)23(24-19)33-15-20(30)25-21-14-28(26-32-21)27(2)3/h4-14H,15H2,1-3H3/b19-13+ | Cc1cccc(c1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N(C)C)c4ccccc4 | |
| AKOS005252735 | 462.524 | C23 H22 N6 O3 S | KHCXEKBCFJLUHO-CPNJWEJPSA-N | InChI=1S/C23H22N6O3S/c1-16-9-11-17(12-10-16)13-19-22(31)29(18-7-5-4-6-8-18)23(24-19)33-15-20(30)25-21-14-28(26-32-21)27(2)3/h4-14H,15H2,1-3H3/b19-13+ | Cc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N(C)C)c4ccccc4 | |
| AKOS005253044 | 462.524 | C23 H22 N6 O3 S | LEEZIRJIOLFTPG-UHFFFAOYSA-N | InChI=1S/C23H22N6O3S/c30-19(24-20-15-29(27-32-20)28-11-13-31-14-12-28)16-33-23-25-21(17-7-3-1-4-8-17)22(26-23)18-9-5-2-6-10-18/h1-10,15H,11-14,16H2,(H-,24,25,26,27,30) | c1ccc(cc1)c2c(nc([nH]2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005253158 | 462.524 | C23 H22 N6 O3 S | NKEGPKWIVHKXOE-UHFFFAOYSA-N | InChI=1S/C23H22N6O3S/c30-20(25-21-15-28(26-32-21)27-13-7-2-8-14-27)16-33-23-24-19-12-6-5-11-18(19)22(31)29(23)17-9-3-1-4-10-17/h1,3-6,9-12,15H,2,7-8,13-14,16H2 | c1ccc(cc1)n2c(=O)c3ccccc3nc2SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005253087 | 494.589 | C23 H22 N6 O3 S2 | POVYOFQQJSAMDR-XMHGGMMESA-N | InChI=1S/C23H22N6O3S2/c30-20(25-21-15-28(26-32-21)27-11-5-2-6-12-27)16-34-23-24-19(14-18-10-7-13-33-18)22(31)29(23)17-8-3-1-4-9-17/h1,3-4,7-10,13-15H,2,5-6,11-12,16H2/b19-14+ | c1ccc(cc1)N2C(=O)/C(=C\c3cccs3)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005251356 | 446.459 | C23 H22 N6 O4 | KCVSSEQCXSRWLM-OCOZRVBESA-N | InChI=1S/C23H22N6O4/c1-27-20(23(32)33-26-27)14-28(17-11-12-17)19-13-21(30)29(22(19)31)18-9-7-16(8-10-18)25-24-15-5-3-2-4-6-15/h2-10,17,19H,11-14H2,1H3/b25-24+ | C[n+]1c(c(on1)[O-])CN(C2CC2)C3CC(=O)N(C3=O)c4ccc(cc4)/N=N/c5ccccc5 | |
| AKOS005252748 | 478.524 | C23 H22 N6 O4 S | ZMWWHHJDNJCJNE-CPNJWEJPSA-N | InChI=1S/C23H22N6O4S/c1-27(2)28-14-21(33-26-28)25-20(30)15-34-23-24-19(13-16-9-11-18(32-3)12-10-16)22(31)29(23)17-7-5-4-6-8-17/h4-14H,15H2,1-3H3/b19-13+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252749 | 478.524 | C23 H22 N6 O4 S | NBXMNNXOBYYGSQ-QGOAFFKASA-N | InChI=1S/C23H22N6O4S/c1-27(2)28-14-21(33-26-28)25-20(30)15-34-23-24-18(13-16-9-7-8-12-19(16)32-3)22(31)29(23)17-10-5-4-6-11-17/h4-14H,15H2,1-3H3/b18-13+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3OC)/C(=O)N2c4ccccc4 | |
| AKOS005252756 | 478.524 | C23 H22 N6 O4 S | XSKGZESKTSPLMK-CPNJWEJPSA-N | InChI=1S/C23H22N6O4S/c1-27(2)28-14-21(33-26-28)25-20(30)15-34-23-24-19(13-16-8-7-11-18(12-16)32-3)22(31)29(23)17-9-5-4-6-10-17/h4-14H,15H2,1-3H3/b19-13+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253127 | 478.524 | C23 H22 N6 O4 S | BAXNULHCOKHHHY-XMHGGMMESA-N | InChI=1S/C23H22N6O4S/c30-20(25-21-15-28(26-33-21)27-11-5-2-6-12-27)16-34-23-24-19(14-18-10-7-13-32-18)22(31)29(23)17-8-3-1-4-9-17/h1,3-4,7-10,13-15H,2,5-6,11-12,16H2/b19-14+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccco3)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005253933 | 478.524 | C23 H22 N6 O4 S | JIUIGXGLQUWDQG-UHFFFAOYSA-N | InChI=1S/C23H22N6O4S/c1-27-22(32)17(13-19(30)24-16-11-7-4-8-12-16)29(23(27)34)14-18-21(33-26-28(18)2)25-20(31)15-9-5-3-6-10-15/h3-12,17H,13-14H2,1-2H3,(H-,24,25,26,30,31) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccccc4 | |
| AKOS005253826 | 494.523 | C23 H22 N6 O5 S | CIEMVAZGYQDCHW-UHFFFAOYSA-N | InChI=1S/C23H22N6O5S/c1-13-3-9-16(10-4-13)29-21(32)17(28(23(29)35)12-18-22(33)34-26-27(18)2)11-19(30)25-15-7-5-14(6-8-15)20(24)31/h3-10,17H,11-12H2,1-2H3,(H3-,24,25,26,30,31,33) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)C(=O)N | |
| AKOS005253912 | 494.523 | C23 H22 N6 O5 S | VXGFIGNTYMNYNT-UHFFFAOYSA-N | InChI=1S/C23H22N6O5S/c1-14(30)24-15-8-10-16(11-9-15)25-20(31)12-18-21(32)29(17-6-4-3-5-7-17)23(35)28(18)13-19-22(33)34-26-27(19)2/h3-11,18,26,33H,12-13H2,1-2H3 | CC(=O)Nc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])c4ccccc4 | |
| AKOS005250901 | 478.457 | C23 H22 N6 O6 | YCJHOMLJZXEQNG-UHFFFAOYSA-O | InChI=1S/C23H21N6O6/c1-26-20(23(32)35-25-26)15-19(24-21(30)16-5-3-2-4-6-16)22(31)28-13-11-27(12-14-28)17-7-9-18(10-8-17)29(33)34/h2-10,15H,11-14H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCN(CC2)c3ccc(cc3)[N+](=O)[O-])\NC(=O)c4ccccc4 | |
| AKOS005253846 | 478.457 | C23 H22 N6 O6 | YCJHOMLJZXEQNG-UHFFFAOYSA-O | InChI=1S/C23H21N6O6/c1-26-20(23(32)35-25-26)15-19(24-21(30)16-5-3-2-4-6-16)22(31)28-13-11-27(12-14-28)17-7-9-18(10-8-17)29(33)34/h2-10,15H,11-14H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCN(CC2)c3ccc(cc3)N(=O)=O)\NC(=O)c4ccccc4 | |
| AKOS005253916 | 526.522 | C23 H22 N6 O7 S | AGZOZTYNCQCFJR-UHFFFAOYSA-N | InChI=1S/C23H22N6O7S/c1-3-35-17-10-8-15(9-11-17)28-21(31)18(27(23(28)37)13-19-22(32)36-25-26(19)2)12-20(30)24-14-4-6-16(7-5-14)29(33)34/h4-11,18H,3,12-13H2,1-2H3,(H-,24,25,30,32) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)N(=O)=O | |
| AKOS005253101 | 474.538 | C23 H22 N8 O2 S | YCWGLZPXWSFNPE-UHFFFAOYSA-N | InChI=1S/C23H22N8O2S/c1-15-5-7-16(8-6-15)21-17(11-24)22(26)28-23(18(21)12-25)34-14-19(32)27-20-13-31(29-33-20)30-9-3-2-4-10-30/h5-8,13H,2-4,9-10,14H2,1H3,(H2-,26,27,28,29,32) | Cc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)N)C#N | |
| AKOS005252956 | 490.538 | C23 H22 N8 O3 S | UGZYRCWALVCBNW-UHFFFAOYSA-N | InChI=1S/C23H22N8O3S/c1-2-15-3-5-16(6-4-15)21-17(11-24)22(26)28-23(18(21)12-25)35-14-19(32)27-20-13-31(29-34-20)30-7-9-33-10-8-30/h3-6,13H,2,7-10,14H2,1H3,(H2-,26,27,28,29,32) | CCc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)N)C#N | |
| AKOS005254123 | 607.5 | C23 H23 Br N6 O5 S2 | PCVGOXLRFRKJHZ-UHFFFAOYSA-N | InChI=1S/C23H23BrN6O5S2/c1-14-4-10-17(11-5-14)37(33,34)26-21-19(29(3)27-35-21)13-30-18(22(32)28(2)23(30)36)12-20(31)25-16-8-6-15(24)7-9-16/h4-11,18H,12-13H2,1-3H3,(H-,25,26,27,31) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)Br | |
| AKOS005254122 | 563.049 | C23 H23 Cl N6 O5 S2 | MRPJBGASWDFLAV-UHFFFAOYSA-N | InChI=1S/C23H23ClN6O5S2/c1-14-4-10-17(11-5-14)37(33,34)26-21-19(29(3)27-35-21)13-30-18(22(32)28(2)23(30)36)12-20(31)25-16-8-6-15(24)7-9-16/h4-11,18H,12-13H2,1-3H3,(H-,25,26,27,31) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)Cl | |
| AKOS005254128 | 546.594 | C23 H23 F N6 O5 S2 | PBZSQQQZQWALCV-UHFFFAOYSA-N | InChI=1S/C23H23FN6O5S2/c1-14-4-10-17(11-5-14)37(33,34)26-21-19(29(3)27-35-21)13-30-18(22(32)28(2)23(30)36)12-20(31)25-16-8-6-15(24)7-9-16/h4-11,18H,12-13H2,1-3H3,(H-,25,26,27,31) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)F | |
| AKOS005254127 | 654.5 | C23 H23 I N6 O5 S2 | NYGSUKXRYSHVPF-UHFFFAOYSA-N | InChI=1S/C23H23IN6O5S2/c1-14-4-10-17(11-5-14)37(33,34)26-21-19(29(3)27-35-21)13-30-18(22(32)28(2)23(30)36)12-20(31)25-16-8-6-15(24)7-9-16/h4-11,18H,12-13H2,1-3H3,(H-,25,26,27,31) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)I | |
| AKOS005252843 | 433.526 | C23 H23 N5 O2 S | PUUCDHAJMUHVPY-UHFFFAOYSA-N | InChI=1S/C23H23N5O2S/c1-15(2)28-13-22(30-27-28)26-21(29)14-31-23-19(12-24)11-18-10-17(8-9-20(18)25-23)16-6-4-3-5-7-16/h3-7,11,13,15,17H,8-10,14H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCC(C3)c4ccccc4)C#N | |
| AKOS005253293 | 449.525 | C23 H23 N5 O3 S | NEJQJZGECZFIIA-UHFFFAOYSA-N | InChI=1S/C23H23N5O3S/c1-30-10-9-28-14-22(31-27-28)26-21(29)15-32-23-19(13-24)12-18-11-17(7-8-20(18)25-23)16-5-3-2-4-6-16/h2-6,12,14,17H,7-11,15H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(cc3c(n2)CCC(C3)c4ccccc4)C#N | |
| AKOS005250939 | 433.46 | C23 H23 N5 O4 | CHGBIRQFKZYTJF-UHFFFAOYSA-O | InChI=1S/C23H22N5O4/c1-26-20(23(31)32-25-26)16-19(24-21(29)17-8-4-2-5-9-17)22(30)28-14-12-27(13-15-28)18-10-6-3-7-11-18/h2-11,16H,12-15H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCN(CC2)c3ccccc3)\NC(=O)c4ccccc4 | |
| AKOS005251018 | 433.46 | C23 H23 N5 O4 | HGWKMABETRYWJK-UHFFFAOYSA-O | InChI=1S/C23H22N5O4/c29-21(17-10-4-1-5-11-17)24-19(22(30)25-27-14-8-3-9-15-27)16-20-23(31)32-26-28(20)18-12-6-2-7-13-18/h1-2,4-7,10-13,16H,3,8-9,14-15H2,(H,25,30)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NN4CCCCC4 | |
| AKOS005251040 | 433.46 | C23 H23 N5 O4 | ANJQSKQSNDCRTA-UHFFFAOYSA-O | InChI=1S/C23H22N5O4/c1-26-12-14-27(15-13-26)22(30)19(24-21(29)17-8-4-2-5-9-17)16-20-23(31)32-25-28(20)18-10-6-3-7-11-18/h2-11,16H,12-15H2,1H3/q-1/p+1 | CN1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005253819 | 465.525 | C23 H23 N5 O4 S | DTSKKLGDIFCWPI-UHFFFAOYSA-N | InChI=1S/C23H23N5O4S/c1-14-4-8-16(9-5-14)24-20(29)12-18-21(30)28(17-10-6-15(2)7-11-17)23(33)27(18)13-19-22(31)32-25-26(19)3/h4-11,18H,12-13H2,1-3H3,(H-,24,25,29,31) | Cc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])c4ccc(cc4)C | |
| AKOS005253820 | 481.524 | C23 H23 N5 O5 S | BBAAQUWXWUTFPK-UHFFFAOYSA-N | InChI=1S/C23H23N5O5S/c1-14-4-8-16(9-5-14)28-21(30)18(12-20(29)24-15-6-10-17(32-3)11-7-15)27(23(28)34)13-19-22(31)33-25-26(19)2/h4-11,18H,12-13H2,1-3H3,(H-,24,25,29,31) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)OC | |
| AKOS005253920 | 481.524 | C23 H23 N5 O5 S | YQZTZBIKAIFQKB-UHFFFAOYSA-N | InChI=1S/C23H23N5O5S/c1-3-32-17-11-9-16(10-12-17)28-21(30)18(13-20(29)24-15-7-5-4-6-8-15)27(23(28)34)14-19-22(31)33-25-26(19)2/h4-12,18H,3,13-14H2,1-2H3,(H-,24,25,29,31) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccccc4 | |
| AKOS005253924 | 481.524 | C23 H23 N5 O5 S | DEHACDCXPJGWDF-UHFFFAOYSA-N | InChI=1S/C23H23N5O5S/c1-3-32-17-11-9-15(10-12-17)24-20(29)13-18-21(30)28(16-7-5-4-6-8-16)23(34)27(18)14-19-22(31)33-25-26(19)2/h4-12,18H,3,13-14H2,1-2H3,(H-,24,25,29,31) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])c4ccccc4 | |
| AKOS005251620 | 513.589 | C23 H23 N5 O5 S2 | JWTFPRKOZYVBAJ-UHFFFAOYSA-N | InChI=1S/C23H23N5O5S2/c1-23(2,3)32-22(31)27-10-9-15-16(11-24)19(35-17(15)12-27)25-18(29)13-34-20-21(30)33-26-28(20)14-7-5-4-6-8-14/h4-8H,9-10,12-13H2,1-3H3,(H-,25,26,29,30) | CC(C)(C)OC(=O)N1CCc2c(sc(c2C#N)NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005252274 | 513.589 | C23 H23 N5 O5 S2 | AGXWQPFZSRGJOM-UHFFFAOYSA-N | InChI=1S/C23H23N5O5S2/c1-4-18(35-22-23(31)33-26-28(22)14-5-7-15(32-3)8-6-14)20(30)25-21-17(11-24)16-9-10-27(13(2)29)12-19(16)34-21/h5-8,18H,4,9-10,12H2,1-3H3,(H-,25,26,30,31) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)C)C#N)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005251007 | 465.459 | C23 H23 N5 O6 | LLVVBWRKZBLUGS-UHFFFAOYSA-O | InChI=1S/C23H22N5O6/c1-32-18-9-7-17(8-10-18)28-20(23(31)34-26-28)15-19(22(30)25-27-11-13-33-14-12-27)24-21(29)16-5-3-2-4-6-16/h2-10,15H,11-14H2,1H3,(H,25,30)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NN3CCOCC3)\NC(=O)c4ccccc4 | |
| AKOS005251327 | 465.459 | C23 H23 N5 O6 | RDCGPXLJQUQSDZ-UHFFFAOYSA-N | InChI=1S/C23H23N5O6/c1-14(29)24-15-4-6-16(7-5-15)27-21(30)12-19(22(27)31)26(2)13-20-23(32)34-25-28(20)17-8-10-18(33-3)11-9-17/h4-11,19H,12-13H2,1-3H3,(H-,24,25,29,32) | CC(=O)Nc1ccc(cc1)N2C(=O)CC(C2=O)N(C)Cc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005253620 | 465.459 | C23 H23 N5 O6 | POZPKKASXJEKJU-UHFFFAOYSA-N | InChI=1S/C23H23N5O6/c1-15(29)24-16-7-9-17(10-8-16)25-21(30)13-20-22(31)27(11-12-33-20)14-19-23(32)34-26-28(19)18-5-3-2-4-6-18/h2-10,20,26,32H,11-14H2,1H3 | CC(=O)Nc1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250187 | 497.524 | C23 H23 N5 O6 S | PVNHUPVGNDHSPF-UHFFFAOYSA-N | InChI=1S/C23H23N5O6S/c1-23(2,3)33-22(31)27-10-9-15-16(11-24)20(35-17(15)12-27)25-19(29)18-21(30)34-26-28(18)13-5-7-14(32-4)8-6-13/h5-8H,9-10,12H2,1-4H3,(H-,25,26,29,30) | CC(C)(C)OC(=O)N1CCc2c(sc(c2C#N)NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005253617 | 481.458 | C23 H23 N5 O7 | MDQVNLOZNWRSRG-UHFFFAOYSA-N | InChI=1S/C23H23N5O7/c1-33-17-8-6-16(7-9-17)28-18(23(32)35-26-28)13-27-10-11-34-19(22(27)31)12-20(29)25-15-4-2-14(3-5-15)21(24)30/h2-9,19H,10-13H2,1H3,(H3-,24,25,26,29,30,32) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)C(=O)N | |
| AKOS005252887 | 461.539 | C23 H23 N7 O2 S | MHYVIFUCBMLOKS-UHFFFAOYSA-N | InChI=1S/C23H23N7O2S/c1-13(2)15-5-7-16(8-6-15)21-17(9-24)22(26)28-23(18(21)10-25)33-12-19(31)27-20-11-30(14(3)4)29-32-20/h5-8,11,13-14H,12H2,1-4H3,(H2-,26,27,28,29,31) | CC(C)c1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)C(C)C)N)C#N | |
| AKOS005253325 | 477.539 | C23 H23 N7 O3 S | VTIGKZNMRSXILF-UHFFFAOYSA-N | InChI=1S/C23H23N7O3S/c1-14(2)15-4-6-16(7-5-15)21-17(10-24)22(26)28-23(18(21)11-25)34-13-19(31)27-20-12-30(29-33-20)8-9-32-3/h4-7,12,14H,8-9,13H2,1-3H3,(H2-,26,27,28,29,31) | CC(C)c1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)CCOC)N)C#N | |
| AKOS005253233 | 493.538 | C23 H23 N7 O4 S | CGAMAGABMZJDID-UHFFFAOYSA-N | InChI=1S/C23H23N7O4S/c1-4-5-10-33-15-8-6-14(7-9-15)27-21(31)13(2)35-22-17(12-25)18(16(11-24)20(26)28-22)19-23(32)34-29-30(19)3/h6-9,13H,4-5,10H2,1-3H3,(H3-,26,27,28,29,31,32) | CCCCOc1ccc(cc1)NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005252872 | 509.538 | C23 H23 N7 O5 S | KYWAHTZIFMQITA-UHFFFAOYSA-N | InChI=1S/C23H23N7O5S/c1-12(2)30-10-19(35-29-30)27-18(31)11-36-23-15(9-25)20(14(8-24)22(26)28-23)13-6-16(32-3)21(34-5)17(7-13)33-4/h6-7,10,12H,11H2,1-5H3,(H2-,26,27,28,29,31) | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3cc(c(c(c3)OC)OC)OC)C#N | |
| AKOS005253313 | 525.537 | C23 H23 N7 O6 S | CAWVZLQVUZULMX-UHFFFAOYSA-N | InChI=1S/C23H23N7O6S/c1-32-6-5-30-11-19(36-29-30)27-18(31)12-37-23-15(10-25)20(14(9-24)22(26)28-23)13-7-16(33-2)21(35-4)17(8-13)34-3/h7-8,11H,5-6,12H2,1-4H3,(H2-,26,27,28,29,31) | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(c(c(c(n2)N)C#N)c3cc(c(c(c3)OC)OC)OC)C#N | |
| AKOS005254042 | 557.602 | C23 H23 N7 O6 S2 | OJMFZKGVEHRCCO-UHFFFAOYSA-N | InChI=1S/C23H23N7O6S2/c1-28-22(33)17(12-19(31)25-15-8-10-16(11-9-15)38(24,34)35)30(23(28)37)13-18-21(36-27-29(18)2)26-20(32)14-6-4-3-5-7-14/h3-11,17H,12-13H2,1-2H3,(H3-,24,25,26,27,31,32,34,35) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)S(=O)(=O)N | |
| AKOS005254131 | 573.601 | C23 H23 N7 O7 S2 | QACRKEVQQHACRX-UHFFFAOYSA-N | InChI=1S/C23H23N7O7S2/c1-14-4-10-17(11-5-14)39(35,36)25-21-19(28(3)26-37-21)13-29-18(22(32)27(2)23(29)38)12-20(31)24-15-6-8-16(9-7-15)30(33)34/h4-11,18H,12-13H2,1-3H3,(H-,24,25,26,31) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)N(=O)=O | |
| AKOS005251610 | 468.592 | C23 H24 N4 O3 S2 | QQTCZLYIZBRZEI-UHFFFAOYSA-N | InChI=1S/C23H24N4O3S2/c1-23(2,3)14-9-10-16-17(12-24)20(32-18(16)11-14)25-19(28)13-31-21-22(29)30-26-27(21)15-7-5-4-6-8-15/h4-8,14H,9-11,13H2,1-3H3,(H-,25,26,28,29) | CC(C)(C)C1CCc2c(sc(c2C#N)NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005251031 | 420.461 | C23 H24 N4 O4 | MUQXJLDDBASASH-UHFFFAOYSA-O | InChI=1S/C23H23N4O4/c1-4-23(2,3)25-21(29)18(24-20(28)16-11-7-5-8-12-16)15-19-22(30)31-26-27(19)17-13-9-6-10-14-17/h5-15H,4H2,1-3H3,(H,25,29)/q-1/p+1 | CCC(C)(C)NC(=O)/C(=C/c1c(on[n+]1c2ccccc2)[O-])/NC(=O)c3ccccc3 | |
| AKOS005250193 | 452.526 | C23 H24 N4 O4 S | YTNWPMPHFHKZTJ-UHFFFAOYSA-N | InChI=1S/C23H24N4O4S/c1-23(2,3)13-5-10-16-17(12-24)21(32-18(16)11-13)25-20(28)19-22(29)31-26-27(19)14-6-8-15(30-4)9-7-14/h6-9,13H,5,10-11H2,1-4H3,(H-,25,26,28,29) | CC(C)(C)C1CCc2c(sc(c2C#N)NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005252390 | 484.591 | C23 H24 N4 O4 S2 | RNMDHMCGZWOHSU-UHFFFAOYSA-N | InChI=1S/C23H24N4O4S2/c1-4-18(20(28)25-21-17(12-24)16-10-5-13(2)11-19(16)32-21)33-22-23(29)31-26-27(22)14-6-8-15(30-3)9-7-14/h6-9,13,18H,4-5,10-11H2,1-3H3,(H-,25,26,28,29) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C)C#N)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005250915 | 436.46 | C23 H24 N4 O5 | KWVJEIMFPQBLCW-UHFFFAOYSA-O | InChI=1S/C23H23N4O5/c1-4-26(5-2)22(29)19(24-21(28)16-9-7-6-8-10-16)15-20-23(30)32-25-27(20)17-11-13-18(31-3)14-12-17/h6-15H,4-5H2,1-3H3/q-1/p+1 | CCN(CC)C(=O)/C(=C/c1c(on[n+]1c2ccc(cc2)OC)[O-])/NC(=O)c3ccccc3 | |
| AKOS005250993 | 436.46 | C23 H24 N4 O5 | OEGJFAURHGGDHL-UHFFFAOYSA-O | InChI=1S/C23H23N4O5/c1-23(2,3)25-21(29)18(24-20(28)15-8-6-5-7-9-15)14-19-22(30)32-26-27(19)16-10-12-17(31-4)13-11-16/h5-14H,1-4H3,(H,25,29)/q-1/p+1 | CC(C)(C)NC(=O)/C(=C/c1c(on[n+]1c2ccc(cc2)OC)[O-])/NC(=O)c3ccccc3 | |
| AKOS005251052 | 436.46 | C23 H24 N4 O5 | VCBXFBKZUSEEQJ-UHFFFAOYSA-O | InChI=1S/C23H23N4O5/c1-2-31-15-9-14-24-22(29)19(25-21(28)17-10-5-3-6-11-17)16-20-23(30)32-26-27(20)18-12-7-4-8-13-18/h3-8,10-13,16H,2,9,14-15H2,1H3,(H,24,29)/q-1/p+1 | CCOCCCNC(=O)/C(=C/c1c(on[n+]1c2ccccc2)[O-])/NC(=O)c3ccccc3 | |
| AKOS005251102 | 436.46 | C23 H24 N4 O5 | BZWCCLJCGLIMGQ-UHFFFAOYSA-O | InChI=1S/C23H23N4O5/c1-4-15(2)24-22(29)19(25-21(28)16-8-6-5-7-9-16)14-20-23(30)32-26-27(20)17-10-12-18(31-3)13-11-17/h5-15H,4H2,1-3H3,(H,24,29)/q-1/p+1 | CCC(C)NC(=O)/C(=C/c1c(on[n+]1c2ccc(cc2)OC)[O-])/NC(=O)c3ccccc3 | |
| AKOS005219855 | 452.46 | C23 H24 N4 O6 | KDIOUBCXRDSBMR-UHFFFAOYSA-N | InChI=1S/C23H24N4O6/c1-32-19-9-5-8-18(12-19)25(15-22(29)30)14-21(28)26(16-10-11-16)13-20-23(31)33-24-27(20)17-6-3-2-4-7-17/h2-9,12,16H,10-11,13-15H2,1H3,(H-,24,29,30,31) | COc1cccc(c1)N(CC(=O)N(Cc2c(on[n+]2c3ccccc3)[O-])C4CC4)CC(=O)O | |
| AKOS005219892 | 452.46 | C23 H24 N4 O6 | LBFBHKGIMDTGEP-UHFFFAOYSA-N | InChI=1S/C23H24N4O6/c1-32-19-11-9-18(10-12-19)27-20(23(31)33-24-27)13-26(17-7-8-17)21(28)14-25(15-22(29)30)16-5-3-2-4-6-16/h2-6,9-12,17H,7-8,13-15H2,1H3,(H-,24,29,30,31) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)CN(CC(=O)O)c4ccccc4 | |
| AKOS005250089 | 452.46 | C23 H24 N4 O6 | QJDCNPKDTREIKQ-UHFFFAOYSA-N | InChI=1S/C23H24N4O6/c1-32-19-11-9-16(10-12-19)25(15-22(29)30)14-21(28)26(17-7-8-17)13-20-23(31)33-24-27(20)18-5-3-2-4-6-18/h2-6,9-12,17H,7-8,13-15H2,1H3,(H-,24,29,30,31) | COc1ccc(cc1)N(CC(=O)N(Cc2c(on[n+]2c3ccccc3)[O-])C4CC4)CC(=O)O | |
| AKOS005250943 | 452.46 | C23 H24 N4 O6 | ASSHNWACFNCQKL-UHFFFAOYSA-O | InChI=1S/C23H23N4O6/c1-27-18(23(30)33-26-27)14-17(25-21(28)16-7-5-4-6-8-16)22(29)24-12-11-15-9-10-19(31-2)20(13-15)32-3/h4-10,13-14H,11-12H2,1-3H3,(H,24,29)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NCCc2ccc(c(c2)OC)OC)\NC(=O)c3ccccc3 | |
| AKOS005251013 | 452.46 | C23 H24 N4 O6 | NRPTYVSGZCCWNY-UHFFFAOYSA-O | InChI=1S/C23H23N4O6/c1-31-14-6-13-24-22(29)19(25-21(28)16-7-4-3-5-8-16)15-20-23(30)33-26-27(20)17-9-11-18(32-2)12-10-17/h3-5,7-12,15H,6,13-14H2,1-2H3,(H,24,29)/q-1/p+1 | COCCCNC(=O)/C(=C/c1c(on[n+]1c2ccc(cc2)OC)[O-])/NC(=O)c3ccccc3 | |
| AKOS005251302 | 452.46 | C23 H24 N4 O6 | MSOYHSNODWTVBY-UHFFFAOYSA-N | InChI=1S/C23H24N4O6/c1-4-32-18-11-5-15(6-12-18)26-21(28)13-19(22(26)29)25(2)14-20-23(30)33-24-27(20)16-7-9-17(31-3)10-8-16/h5-12,19H,4,13-14H2,1-3H3 | CCOc1ccc(cc1)N2C(=O)CC(C2=O)N(C)Cc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005253594 | 452.46 | C23 H24 N4 O6 | CFWPCZWCYQMWSD-UHFFFAOYSA-N | InChI=1S/C23H24N4O6/c1-15-3-5-16(6-4-15)24-21(28)13-20-22(29)26(11-12-32-20)14-19-23(30)33-25-27(19)17-7-9-18(31-2)10-8-17/h3-10,20H,11-14H2,1-2H3,(H-,24,25,28,30) | Cc1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005253603 | 452.46 | C23 H24 N4 O6 | LDQWQCUDEVSPDW-UHFFFAOYSA-N | InChI=1S/C23H24N4O6/c1-2-31-18-10-8-16(9-11-18)24-21(28)14-20-22(29)26(12-13-32-20)15-19-23(30)33-25-27(19)17-6-4-3-5-7-17/h3-11,20H,2,12-15H2,1H3,(H-,24,25,28,30) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251672 | 516.59 | C23 H24 N4 O6 S2 | SLGPFPAFXNDNHU-UHFFFAOYSA-N | InChI=1S/C23H24N4O6S2/c1-4-32-22(30)18-16-10-11-26(14(3)28)12-17(16)35-20(18)24-19(29)13(2)34-21-23(31)33-25-27(21)15-8-6-5-7-9-15/h5-9,13H,4,10-12H2,1-3H3,(H-,24,25,29,30,31) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccccc4)[O-])CN(CC2)C(=O)C | |
| AKOS005252388 | 516.59 | C23 H24 N4 O6 S2 | NSBNBCVZICBVHB-UHFFFAOYSA-N | InChI=1S/C23H24N4O6S2/c1-4-16(35-21-23(31)33-25-27(21)14-8-6-5-7-9-14)19(29)24-20-18(22(30)32-3)15-10-11-26(13(2)28)12-17(15)34-20/h5-9,16H,4,10-12H2,1-3H3,(H-,24,25,29,30,31) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)C)C(=O)OC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252571 | 516.59 | C23 H24 N4 O6 S2 | XNYRKDQYSHBMNO-UHFFFAOYSA-N | InChI=1S/C23H24N4O6S2/c1-3-32-22(30)19-16-9-11-26(14(2)28)13-17(16)35-20(19)24-18(29)10-12-34-21-23(31)33-25-27(21)15-7-5-4-6-8-15/h4-8H,3,9-13H2,1-2H3,(H-,24,25,29,30,31) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])CN(CC2)C(=O)C | |
| AKOS005250998 | 468.459 | C23 H24 N4 O7 | VHBRYIDYQFSBDC-UHFFFAOYSA-O | InChI=1S/C23H23N4O7/c1-31-17-11-9-16(10-12-17)27-19(23(30)34-26-27)13-18(22(29)24-14-20(32-2)33-3)25-21(28)15-7-5-4-6-8-15/h4-13,20H,14H2,1-3H3,(H,24,29)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCC(OC)OC)\NC(=O)c3ccccc3 | |
| AKOS005253601 | 468.459 | C23 H24 N4 O7 | NLCXQYAWFGMDGN-UHFFFAOYSA-N | InChI=1S/C23H24N4O7/c1-31-17-7-3-15(4-8-17)24-21(28)13-20-22(29)26(11-12-33-20)14-19-23(30)34-25-27(19)16-5-9-18(32-2)10-6-16/h3-10,20H,11-14H2,1-2H3,(H-,24,25,28,30) | COc1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005251388 | 532.589 | C23 H24 N4 O7 S2 | IIEMEPWPCIMFDD-UHFFFAOYSA-N | InChI=1S/C23H24N4O7S2/c1-4-33-22(30)19-16-9-10-26(13(2)28)11-17(16)36-20(19)24-18(29)12-35-21-23(31)34-25-27(21)14-5-7-15(32-3)8-6-14/h5-8H,4,9-12H2,1-3H3,(H-,24,25,29,30,31) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])CN(CC2)C(=O)C | |
| AKOS005251722 | 532.589 | C23 H24 N4 O7 S2 | XGTAWPZONKJYMX-UHFFFAOYSA-N | InChI=1S/C23H24N4O7S2/c1-12(35-21-23(31)34-25-27(21)14-5-7-15(32-3)8-6-14)19(29)24-20-18(22(30)33-4)16-9-10-26(13(2)28)11-17(16)36-20/h5-8,12H,9-11H2,1-4H3,(H-,24,25,29,30,31) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)C)C(=O)OC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252582 | 532.589 | C23 H24 N4 O7 S2 | QFOGPNYZEMSQJI-UHFFFAOYSA-N | InChI=1S/C23H24N4O7S2/c1-13(28)26-10-8-16-17(12-26)36-20(19(16)22(30)33-3)24-18(29)9-11-35-21-23(31)34-25-27(21)14-4-6-15(32-2)7-5-14/h4-7H,8-12H2,1-3H3,(H-,24,25,29,30,31) | CC(=O)N1CCc2c(sc(c2C(=O)OC)NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005254108 | 528.604 | C23 H24 N6 O5 S2 | DRUVWZZMNXTDRR-UHFFFAOYSA-N | InChI=1S/C23H24N6O5S2/c1-15-9-11-17(12-10-15)36(32,33)25-21-19(28(3)26-34-21)14-29-18(22(31)27(2)23(29)35)13-20(30)24-16-7-5-4-6-8-16/h4-12,18H,13-14H2,1-3H3,(H-,24,25,26,30) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccccc4 | |
| AKOS005253817 | 560.603 | C23 H24 N6 O7 S2 | FYKVEEWYZGQXAS-UHFFFAOYSA-N | InChI=1S/C23H24N6O7S2/c1-3-35-16-8-6-15(7-9-16)29-21(31)18(28(23(29)37)13-19-22(32)36-26-27(19)2)12-20(30)25-14-4-10-17(11-5-14)38(24,33)34/h4-11,18H,3,12-13H2,1-2H3,(H3-,24,25,26,30,32,33,34) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)S(=O)(=O)N | |
| AKOS005251915 | 455.527 | C23 H25 N3 O5 S | GYIXCBABQIQIMK-UHFFFAOYSA-N | InChI=1S/C23H25N3O5S/c1-3-5-15-30-22(28)16-11-13-17(14-12-16)24-20(27)19(4-2)32-21-23(29)31-25-26(21)18-9-7-6-8-10-18/h6-14,19H,3-5,15H2,1-2H3,(H-,24,25,27,28,29) | CCCCOC(=O)c1ccc(cc1)NC(=O)C(CC)Sc2c(on[n+]2c3ccccc3)[O-] | |
| AKOS005251627 | 487.592 | C23 H25 N3 O5 S2 | PAQFHNFGLXOOFA-UHFFFAOYSA-N | InChI=1S/C23H25N3O5S2/c1-2-30-22(28)19-16-12-8-3-4-9-13-17(16)33-20(19)24-18(27)14-32-21-23(29)31-25-26(21)15-10-6-5-7-11-15/h5-7,10-11H,2-4,8-9,12-14H2,1H3,(H-,24,25,27,28,29) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])CCCCCC2 | |
| AKOS005251663 | 487.592 | C23 H25 N3 O5 S2 | PIYGVYKYSRCSCN-UHFFFAOYSA-N | InChI=1S/C23H25N3O5S2/c1-4-30-22(28)18-16-11-10-13(2)12-17(16)33-20(18)24-19(27)14(3)32-21-23(29)31-25-26(21)15-8-6-5-7-9-15/h5-9,13-14H,4,10-12H2,1-3H3,(H-,24,25,27,28,29) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccccc4)[O-])CC(CC2)C | |
| AKOS005251742 | 487.592 | C23 H25 N3 O5 S2 | ITUBULKWRQETSO-UHFFFAOYSA-N | InChI=1S/C23H25N3O5S2/c1-4-30-22(28)18-16-11-10-15(14-8-6-5-7-9-14)12-17(16)33-20(18)24-19(27)13(2)32-21-23(29)31-25-26(21)3/h5-9,13,15H,4,10-12H2,1-3H3,(H-,24,25,27,28,29) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3C)[O-])CC(CC2)c4ccccc4 | |
| AKOS005251748 | 487.592 | C23 H25 N3 O5 S2 | CVQQBTCFQPEBPT-UHFFFAOYSA-N | InChI=1S/C23H25N3O5S2/c1-3-30-22(28)18-16-12-8-5-9-13-17(16)33-20(18)24-19(27)14(2)32-21-23(29)31-25-26(21)15-10-6-4-7-11-15/h4,6-7,10-11,14H,3,5,8-9,12-13H2,1-2H3,(H-,24,25,27,28,29) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccccc4)[O-])CCCCC2 | |
| AKOS005251749 | 487.592 | C23 H25 N3 O5 S2 | XMAANCUOLNBASD-UHFFFAOYSA-N | InChI=1S/C23H25N3O5S2/c1-14(32-21-23(29)31-25-26(21)15-10-6-5-7-11-15)19(27)24-20-18(22(28)30-2)16-12-8-3-4-9-13-17(16)33-20/h5-7,10-11,14H,3-4,8-9,12-13H2,1-2H3,(H-,24,25,27,28,29) | CC(C(=O)Nc1c(c2c(s1)CCCCCC2)C(=O)OC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251916 | 487.592 | C23 H25 N3 O5 S2 | ZVOWLZXULZFCJL-UHFFFAOYSA-N | InChI=1S/C23H25N3O5S2/c1-3-16(33-21-23(29)31-25-26(21)14-10-6-4-7-11-14)19(27)24-20-18(22(28)30-2)15-12-8-5-9-13-17(15)32-20/h4,6-7,10-11,16H,3,5,8-9,12-13H2,1-2H3,(H-,24,25,27,28,29) | CCC(C(=O)Nc1c(c2c(s1)CCCCC2)C(=O)OC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251970 | 487.592 | C23 H25 N3 O5 S2 | KEOZXXSSVPBLAQ-UHFFFAOYSA-N | InChI=1S/C23H25N3O5S2/c1-3-16(33-21-23(29)31-25-26(21)14-10-6-5-7-11-14)19(27)24-20-18(22(28)30-4-2)15-12-8-9-13-17(15)32-20/h5-7,10-11,16H,3-4,8-9,12-13H2,1-2H3,(H-,24,25,27,28,29) | CCC(C(=O)Nc1c(c2c(s1)CCCC2)C(=O)OCC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251974 | 487.592 | C23 H25 N3 O5 S2 | ZECCTUREWZGUNN-UHFFFAOYSA-N | InChI=1S/C23H25N3O5S2/c1-4-16(33-21-23(29)31-25-26(21)2)19(27)24-20-18(22(28)30-3)15-11-10-14(12-17(15)32-20)13-8-6-5-7-9-13/h5-9,14,16H,4,10-12H2,1-3H3,(H-,24,25,27,28,29) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)c3ccccc3)C(=O)OC)Sc4c(on[n+]4C)[O-] | |
| AKOS005251986 | 487.592 | C23 H25 N3 O5 S2 | XSEQYNIQUZKYBU-UHFFFAOYSA-N | InChI=1S/C23H25N3O5S2/c1-4-16(33-21-23(29)31-25-26(21)14-8-6-5-7-9-14)19(27)24-20-18(22(28)30-3)15-11-10-13(2)12-17(15)32-20/h5-9,13,16H,4,10-12H2,1-3H3,(H-,24,25,27,28,29) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C)C(=O)OC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252550 | 487.592 | C23 H25 N3 O5 S2 | LUFHXZUSRYYGEU-UHFFFAOYSA-N | InChI=1S/C23H25N3O5S2/c1-2-30-22(28)19-16-11-7-4-8-12-17(16)33-20(19)24-18(27)13-14-32-21-23(29)31-25-26(21)15-9-5-3-6-10-15/h3,5-6,9-10H,2,4,7-8,11-14H2,1H3,(H-,24,25,27,28,29) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])CCCCC2 | |
| AKOS005252551 | 487.592 | C23 H25 N3 O5 S2 | NFOXNPYHAFZWLQ-UHFFFAOYSA-N | InChI=1S/C23H25N3O5S2/c1-30-22(28)19-16-11-7-2-3-8-12-17(16)33-20(19)24-18(27)13-14-32-21-23(29)31-25-26(21)15-9-5-4-6-10-15/h4-6,9-10H,2-3,7-8,11-14H2,1H3,(H-,24,25,27,28,29) | COC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])CCCCCC2 | |
| AKOS005252556 | 487.592 | C23 H25 N3 O5 S2 | MYUWDHSXBBGCBN-UHFFFAOYSA-N | InChI=1S/C23H25N3O5S2/c1-3-30-22(28)19-16-10-9-14(2)13-17(16)33-20(19)24-18(27)11-12-32-21-23(29)31-25-26(21)15-7-5-4-6-8-15/h4-8,14H,3,9-13H2,1-2H3,(H-,24,25,27,28,29) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])CC(CC2)C | |
| AKOS005252659 | 487.592 | C23 H25 N3 O5 S2 | VHEPSJXAHFSKOY-UHFFFAOYSA-N | InChI=1S/C23H25N3O5S2/c1-3-30-22(28)19-16-10-9-15(14-7-5-4-6-8-14)13-17(16)33-20(19)24-18(27)11-12-32-21-23(29)31-25-26(21)2/h4-8,15H,3,9-13H2,1-2H3,(H-,24,25,27,28,29) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3C)[O-])CC(CC2)c4ccccc4 | |
| AKOS005250210 | 471.526 | C23 H25 N3 O6 S | KCGOBDHZBFBRDG-UHFFFAOYSA-N | InChI=1S/C23H25N3O6S/c1-3-31-22(28)18-16-8-6-4-5-7-9-17(16)33-21(18)24-20(27)19-23(29)32-25-26(19)14-10-12-15(30-2)13-11-14/h10-13H,3-9H2,1-2H3,(H-,24,25,27,28,29) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])CCCCCC2 | |
| AKOS005251793 | 471.526 | C23 H25 N3 O6 S | VUWMBMPMXODUHU-UHFFFAOYSA-N | InChI=1S/C23H25N3O6S/c1-4-5-14-31-22(28)16-6-8-17(9-7-16)24-20(27)15(2)33-21-23(29)32-25-26(21)18-10-12-19(30-3)13-11-18/h6-13,15H,4-5,14H2,1-3H3,(H-,24,25,27,28,29) | CCCCOC(=O)c1ccc(cc1)NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005252198 | 471.526 | C23 H25 N3 O6 S | QKHWZZPAIFUMTF-UHFFFAOYSA-N | InChI=1S/C23H25N3O6S/c1-3-4-14-31-22(28)16-5-7-17(8-6-16)24-20(27)13-15-33-21-23(29)32-25-26(21)18-9-11-19(30-2)12-10-18/h5-12H,3-4,13-15H2,1-2H3,(H-,24,25,27,28,29) | CCCCOC(=O)c1ccc(cc1)NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251384 | 503.591 | C23 H25 N3 O6 S2 | APKNMQDTNJKLKD-UHFFFAOYSA-N | InChI=1S/C23H25N3O6S2/c1-3-31-22(28)19-16-7-5-4-6-8-17(16)34-20(19)24-18(27)13-33-21-23(29)32-25-26(21)14-9-11-15(30-2)12-10-14/h9-12H,3-8,13H2,1-2H3,(H-,24,25,27,28,29) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])CCCCC2 | |
| AKOS005251385 | 503.591 | C23 H25 N3 O6 S2 | WUJRYKOIWNRIEG-UHFFFAOYSA-N | InChI=1S/C23H25N3O6S2/c1-30-15-11-9-14(10-12-15)26-21(23(29)32-25-26)33-13-18(27)24-20-19(22(28)31-2)16-7-5-3-4-6-8-17(16)34-20/h9-12H,3-8,13H2,1-2H3,(H-,24,25,27,28,29) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3c(c4c(s3)CCCCCC4)C(=O)OC | |
| AKOS005251524 | 503.591 | C23 H25 N3 O6 S2 | HONGWGYBWWADLB-UHFFFAOYSA-N | InChI=1S/C23H25N3O6S2/c1-4-31-22(28)19-16-10-5-13(2)11-17(16)34-20(19)24-18(27)12-33-21-23(29)32-25-26(21)14-6-8-15(30-3)9-7-14/h6-9,13H,4-5,10-12H2,1-3H3,(H-,24,25,27,28,29) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])CC(CC2)C | |
| AKOS005251705 | 503.591 | C23 H25 N3 O6 S2 | QPGNMYCNVNIJMA-UHFFFAOYSA-N | InChI=1S/C23H25N3O6S2/c1-13(33-21-23(29)32-25-26(21)14-9-11-15(30-2)12-10-14)19(27)24-20-18(22(28)31-3)16-7-5-4-6-8-17(16)34-20/h9-13H,4-8H2,1-3H3,(H-,24,25,27,28,29) | CC(C(=O)Nc1c(c2c(s1)CCCCC2)C(=O)OC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005251707 | 503.591 | C23 H25 N3 O6 S2 | LFNVEXOMFDJDDY-UHFFFAOYSA-N | InChI=1S/C23H25N3O6S2/c1-4-31-22(28)18-16-7-5-6-8-17(16)34-20(18)24-19(27)13(2)33-21-23(29)32-25-26(21)14-9-11-15(30-3)12-10-14/h9-13H,4-8H2,1-3H3,(H-,24,25,27,28,29) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccc(cc4)OC)[O-])CCCC2 | |
| AKOS005251739 | 503.591 | C23 H25 N3 O6 S2 | NURHKAFSEFSTGC-UHFFFAOYSA-N | InChI=1S/C23H25N3O6S2/c1-12-5-10-16-17(11-12)34-20(18(16)22(28)31-4)24-19(27)13(2)33-21-23(29)32-25-26(21)14-6-8-15(30-3)9-7-14/h6-9,12-13H,5,10-11H2,1-4H3,(H-,24,25,27,28,29) | CC1CCc2c(sc(c2C(=O)OC)NC(=O)C(C)Sc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005252272 | 503.591 | C23 H25 N3 O6 S2 | ACAAFKQDUCWZNJ-UHFFFAOYSA-N | InChI=1S/C23H25N3O6S2/c1-4-16(34-21-23(29)32-25-26(21)13-9-11-14(30-2)12-10-13)19(27)24-20-18(22(28)31-3)15-7-5-6-8-17(15)33-20/h9-12,16H,4-8H2,1-3H3,(H-,24,25,27,28,29) | CCC(C(=O)Nc1c(c2c(s1)CCCC2)C(=O)OC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252593 | 503.591 | C23 H25 N3 O6 S2 | IIWXDWQFUONLAZ-UHFFFAOYSA-N | InChI=1S/C23H25N3O6S2/c1-13-4-9-16-17(12-13)34-20(19(16)22(28)31-3)24-18(27)10-11-33-21-23(29)32-25-26(21)14-5-7-15(30-2)8-6-14/h5-8,13H,4,9-12H2,1-3H3,(H-,24,25,27,28,29) | CC1CCc2c(sc(c2C(=O)OC)NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005252621 | 503.591 | C23 H25 N3 O6 S2 | KETXUHMIAMRIBR-UHFFFAOYSA-N | InChI=1S/C23H25N3O6S2/c1-30-15-10-8-14(9-11-15)26-21(23(29)32-25-26)33-13-12-18(27)24-20-19(22(28)31-2)16-6-4-3-5-7-17(16)34-20/h8-11H,3-7,12-13H2,1-2H3,(H-,24,25,27,28,29) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3c(c4c(s3)CCCCC4)C(=O)OC | |
| AKOS005252632 | 503.591 | C23 H25 N3 O6 S2 | MKHHCQJHEBXTMA-UHFFFAOYSA-N | InChI=1S/C23H25N3O6S2/c1-3-31-22(28)19-16-6-4-5-7-17(16)34-20(19)24-18(27)12-13-33-21-23(29)32-25-26(21)14-8-10-15(30-2)11-9-14/h8-11H,3-7,12-13H2,1-2H3,(H-,24,25,27,28,29) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])CCCC2 | |
| AKOS005251025 | 435.476 | C23 H25 N5 O4 | FLAVMFQCNFYDPT-UHFFFAOYSA-O | InChI=1S/C23H24N5O4/c1-27(2)15-9-14-24-22(30)19(25-21(29)17-10-5-3-6-11-17)16-20-23(31)32-26-28(20)18-12-7-4-8-13-18/h3-8,10-13,16H,9,14-15H2,1-2H3,(H,24,30)/q-1/p+1 | CN(C)CCCNC(=O)/C(=C/c1c(on[n+]1c2ccccc2)[O-])/NC(=O)c3ccccc3 | |
| AKOS005251009 | 451.475 | C23 H25 N5 O5 | SYERYIQVBMQZAL-UHFFFAOYSA-O | InChI=1S/C23H24N5O5/c1-27(2)14-13-24-22(30)19(25-21(29)16-7-5-4-6-8-16)15-20-23(31)33-26-28(20)17-9-11-18(32-3)12-10-17/h4-12,15H,13-14H2,1-3H3,(H,24,30)/q-1/p+1 | CN(C)CCNC(=O)/C(=C/c1c(on[n+]1c2ccc(cc2)OC)[O-])/NC(=O)c3ccccc3 | |
| AKOS005254132 | 607.682 | C23 H25 N7 O7 S3 | LATLJNWMQHYYCU-UHFFFAOYSA-N | InChI=1S/C23H25N7O7S3/c1-14-4-8-17(9-5-14)40(35,36)26-21-19(29(3)27-37-21)13-30-18(22(32)28(2)23(30)38)12-20(31)25-15-6-10-16(11-7-15)39(24,33)34/h4-11,18H,12-13H2,1-3H3,(H3-,24,25,26,27,31,33,34) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)S(=O)(=O)N | |
| AKOS005251655 | 502.606 | C23 H26 N4 O5 S2 | HDJDXUJGMCECKT-UHFFFAOYSA-N | InChI=1S/C23H26N4O5S2/c1-4-31-22(29)18-16-10-11-27(12-15-8-6-5-7-9-15)13-17(16)34-20(18)24-19(28)14(2)33-21-23(30)32-25-26(21)3/h5-9,14H,4,10-13H2,1-3H3,(H-,24,25,28,29,30) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3C)[O-])CN(CC2)Cc4ccccc4 | |
| AKOS005251922 | 502.606 | C23 H26 N4 O5 S2 | CXSZYZHDJUHNAG-UHFFFAOYSA-N | InChI=1S/C23H26N4O5S2/c1-4-16(34-21-23(30)32-25-26(21)2)19(28)24-20-18(22(29)31-3)15-10-11-27(13-17(15)33-20)12-14-8-6-5-7-9-14/h5-9,16H,4,10-13H2,1-3H3,(H-,24,25,28,29,30) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)Cc3ccccc3)C(=O)OC)Sc4c(on[n+]4C)[O-] | |
| AKOS005252653 | 502.606 | C23 H26 N4 O5 S2 | LBYXKOKSODZLSI-UHFFFAOYSA-N | InChI=1S/C23H26N4O5S2/c1-3-31-22(29)19-16-9-11-27(13-15-7-5-4-6-8-15)14-17(16)34-20(19)24-18(28)10-12-33-21-23(30)32-25-26(21)2/h4-8H,3,9-14H2,1-2H3,(H-,24,25,28,29,30) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3C)[O-])CN(CC2)Cc4ccccc4 | |
| AKOS005252057 | 457.543 | C23 H27 N3 O5 S | VGTNWCLKNSYKJN-UHFFFAOYSA-N | InChI=1S/C23H27N3O5S/c1-4-6-15-30-19-11-7-16(8-12-19)24-21(27)20(5-2)32-22-23(28)31-25-26(22)17-9-13-18(29-3)14-10-17/h7-14,20H,4-6,15H2,1-3H3,(H-,24,25,27,28) | CCCCOc1ccc(cc1)NC(=O)C(CC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005219482 | 409.461 | C23 H28 N3 O2 P | RVUUFIDZLFHCPK-UHFFFAOYSA-N | InChI=1S/C23H28N3O2P/c1-5-6-17-26-21(20(28-25-26)24-22(27)23(2,3)4)29(18-13-9-7-10-14-18)19-15-11-8-12-16-19/h7-16H,5-6,17H2,1-4H3 | CCCC[n+]1c(c(on1)[N-]C(=O)C(C)(C)C)P(c2ccccc2)c3ccccc3 | |
| AKOS005253055 | 454.588 | C23 H30 N6 O2 S | COXAAXIYMXJCQR-UHFFFAOYSA-N | InChI=1S/C23H30N6O2S/c1-23(2,3)18-7-8-19-16(12-18)11-17(13-24)22(25-19)32-15-20(30)26-21-14-29(27-31-21)28-9-5-4-6-10-28/h11,14,18H,4-10,12,15H2,1-3H3 | CC(C)(C)C1CCc2c(cc(c(n2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)C#N)C1 | |
| AKOS005253883 | 530.906 | C24 H14 Cl F3 N4 O3 S | IIKXBENHIZMQBH-UHFFFAOYSA-N | InChI=1S/C24H14ClF3N4O3S/c1-32-19(23(34)35-31-32)20(33)21-18(29)17-15(11-2-6-13(7-3-11)24(26,27)28)10-16(30-22(17)36-21)12-4-8-14(25)9-5-12/h2-10H,1H3,(H2-,29,31,33,34) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4ccc(cc4)Cl)c5ccc(cc5)C(F)(F)F)N | |
| AKOS005254088 | 518.932 | C24 H15 Cl N6 O4 S | PQDVHLPADJWJMW-UHFFFAOYSA-N | InChI=1S/C24H15ClN6O4S/c1-34-14-8-6-13(7-9-14)31-19(24(33)35-30-31)20(32)21-18(27)17-16(11-2-4-12(25)5-3-11)15(10-26)22(28)29-23(17)36-21/h2-9H,1H3,(H4-,27,28,29,30,32,33) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(c(c(nc4s3)N)C#N)c5ccc(cc5)Cl)N | |
| AKOS005253903 | 496.461 | C24 H15 F3 N4 O3 S | NILJGXIROQMPKC-UHFFFAOYSA-N | InChI=1S/C24H15F3N4O3S/c1-31-19(23(33)34-30-31)20(32)21-18(28)17-15(12-7-9-14(10-8-12)24(25,26)27)11-16(29-22(17)35-21)13-5-3-2-4-6-13/h2-11H,1H3,(H2-,28,30,32,33) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4ccccc4)c5ccc(cc5)C(F)(F)F)N | |
| AKOS005250435 | 512.46 | C24 H15 F3 N4 O4 S | HDXCHXDTGSGBSJ-UHFFFAOYSA-N | InChI=1S/C24H15F3N4O4S/c1-34-16-9-7-15(8-10-16)31-21(23(33)35-30-31)20(32)13-36-22-17(12-28)18(24(25,26)27)11-19(29-22)14-5-3-2-4-6-14/h2-11H,13H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(c(cc(n3)c4ccccc4)C(F)(F)F)C#N | |
| AKOS005250830 | 512.46 | C24 H15 F3 N4 O4 S | GLZNYLBRTOARGF-UHFFFAOYSA-N | InChI=1S/C24H15F3N4O4S/c1-34-16-9-7-14(8-10-16)19-11-18(24(25,26)27)17(12-28)22(29-19)36-13-20(32)21-23(33)35-30-31(21)15-5-3-2-4-6-15/h2-11H,13H2,1H3 | COc1ccc(cc1)c2cc(c(c(n2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])C#N)C(F)(F)F | |
| AKOS005253684 | 512.46 | C24 H15 F3 N4 O4 S | CXCAEYYXTYIFFH-UHFFFAOYSA-N | InChI=1S/C24H15F3N4O4S/c1-34-14-9-7-12(8-10-14)16-11-15(24(25,26)27)17-18(28)21(36-22(17)29-16)20(32)19-23(33)35-30-31(19)13-5-3-2-4-6-13/h2-11H,1H3,(H2-,28,30,32,33) | COc1ccc(cc1)c2cc(c3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)C(F)(F)F | |
| AKOS005253774 | 512.46 | C24 H15 F3 N4 O4 S | ZRIINMMMOQSFRJ-UHFFFAOYSA-N | InChI=1S/C24H15F3N4O4S/c1-34-14-9-7-13(8-10-14)31-19(23(33)35-30-31)20(32)21-18(28)17-15(24(25,26)27)11-16(29-22(17)36-21)12-5-3-2-4-6-12/h2-11H,1H3,(H2-,28,30,32,33) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5ccccc5)C(F)(F)F)N | |
| AKOS005250448 | 469.472 | C24 H15 N5 O4 S | FQDUVCWAVLMROA-UHFFFAOYSA-N | InChI=1S/C24H15N5O4S/c1-32-15-10-8-14(9-11-15)29-22(23(31)33-28-29)18(30)12-34-24-25-20-16-6-2-4-13-5-3-7-17(19(13)16)21(20)26-27-24/h2-11H,12H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nc-4c(nn3)-c5cccc6c5c4ccc6 | |
| AKOS005253851 | 494.47 | C24 H16 F2 N4 O4 S | NGRYVCQMCGPGJC-UHFFFAOYSA-N | InChI=1S/C24H16F2N4O4S/c1-30-20(24(32)34-29-30)21(31)22-19(27)18-15(14-8-5-12(25)9-16(14)26)10-17(28-23(18)35-22)11-3-6-13(33-2)7-4-11/h3-10H,1-2H3,(H2-,27,29,31,32) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4ccc(cc4)OC)c5ccc(cc5F)F)N | |
| AKOS005250810 | 456.473 | C24 H16 N4 O4 S | LOSKWASYCOXFII-UHFFFAOYSA-N | InChI=1S/C24H16N4O4S/c29-20(21-23(31)32-26-28(21)17-11-5-2-6-12-17)15-33-24-25-19-14-8-7-13-18(19)22(30)27(24)16-9-3-1-4-10-16/h1-14H,15H2 | c1ccc(cc1)n2c(=O)c3ccccc3nc2SCC(=O)c4c(on[n+]4c5ccccc5)[O-] | |
| AKOS005250772 | 488.538 | C24 H16 N4 O4 S2 | QTTUXZBDZMDYSR-XMHGGMMESA-N | InChI=1S/C24H16N4O4S2/c29-20(21-23(31)32-26-28(21)17-10-5-2-6-11-17)15-34-24-25-19(14-18-12-7-13-33-18)22(30)27(24)16-8-3-1-4-9-16/h1-14H,15H2/b19-14+ | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4cccs4)/C(=O)N3c5ccccc5 | |
| AKOS005250770 | 472.473 | C24 H16 N4 O5 S | PFZIFOAKIOPOTH-XMHGGMMESA-N | InChI=1S/C24H16N4O5S/c29-20(21-23(31)33-26-28(21)17-10-5-2-6-11-17)15-34-24-25-19(14-18-12-7-13-32-18)22(30)27(24)16-8-3-1-4-9-16/h1-14H,15H2/b19-14+ | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccco4)/C(=O)N3c5ccccc5 | |
| AKOS005254185 | 488.472 | C24 H16 N4 O6 S | XCCBVMMGNWBDKA-UHFFFAOYSA-N | InChI=1S/C24H16N4O6S/c1-31-14-5-3-13(4-6-14)28-20(24(30)34-27-28)21(29)22-19(25)15-7-8-16(26-23(15)35-22)12-2-9-17-18(10-12)33-11-32-17/h2-10H,11H2,1H3,(H2-,25,27,29,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4ccc(nc4s3)c5ccc6c(c5)OCO6)N | |
| AKOS005250848 | 468.487 | C24 H16 N6 O3 S | UUAGTSCABUTGNW-UHFFFAOYSA-N | InChI=1S/C24H16N6O3S/c1-14-7-9-15(10-8-14)20-17(11-25)22(27)28-23(18(20)12-26)34-13-19(31)21-24(32)33-29-30(21)16-5-3-2-4-6-16/h2-10H,13H2,1H3,(H2-,27,28,29,31,32) | Cc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])N)C#N | |
| AKOS005253760 | 468.487 | C24 H16 N6 O3 S | CTZKATUCIDILPY-UHFFFAOYSA-N | InChI=1S/C24H16N6O3S/c1-12-7-9-13(10-8-12)16-15(11-25)22(27)28-23-17(16)18(26)21(34-23)20(31)19-24(32)33-29-30(19)14-5-3-2-4-6-14/h2-10H,1H3,(H4-,26,27,28,29,31,32) | Cc1ccc(cc1)c2c(c(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)N)C#N | |
| AKOS005250422 | 484.487 | C24 H16 N6 O4 S | YHJHBTROOJDGDO-UHFFFAOYSA-N | InChI=1S/C24H16N6O4S/c1-33-16-9-7-15(8-10-16)30-21(24(32)34-29-30)19(31)13-35-23-18(12-26)20(14-5-3-2-4-6-14)17(11-25)22(27)28-23/h2-10H,13H2,1H3,(H2-,27,28,29,31,32) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(c(c(c(n3)N)C#N)c4ccccc4)C#N | |
| AKOS005253775 | 484.487 | C24 H16 N6 O4 S | SPUCCXNRSIYXPT-UHFFFAOYSA-N | InChI=1S/C24H16N6O4S/c1-33-14-9-7-13(8-10-14)30-19(24(32)34-29-30)20(31)21-18(26)17-16(12-5-3-2-4-6-12)15(11-25)22(27)28-23(17)35-21/h2-10H,1H3,(H4-,26,27,28,29,31,32) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(c(c(nc4s3)N)C#N)c5ccccc5)N | |
| AKOS005253861 | 476.935 | C24 H17 Cl N4 O3 S | FBGJQPOXYHKSLU-UHFFFAOYSA-N | InChI=1S/C24H17ClN4O3S/c1-12-3-5-13(6-4-12)16-11-17(14-7-9-15(25)10-8-14)27-23-18(16)19(26)22(33-23)21(30)20-24(31)32-28-29(20)2/h3-11H,1-2H3,(H2-,26,28,30,31) | Cc1ccc(cc1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4C)[O-])N)c5ccc(cc5)Cl | |
| AKOS005253785 | 476.48 | C24 H17 F N4 O4 S | ATKKIECTEOHPRN-UHFFFAOYSA-N | InChI=1S/C24H17FN4O4S/c1-29-20(24(31)33-28-29)21(30)22-19(26)18-16(13-4-3-5-14(25)10-13)11-17(27-23(18)34-22)12-6-8-15(32-2)9-7-12/h3-11H,1-2H3,(H2-,26,28,30,31) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4ccc(cc4)OC)c5cccc(c5)F)N | |
| AKOS005253440 | 499.501 | C24 H17 N7 O4 S | MQLHVUHQGAKCKW-UHFFFAOYSA-N | InChI=1S/C24H17N7O4S/c1-31-19(24(33)35-30-31)16-15(11-25)21(27)29-23-17(16)18(26)20(36-23)22(32)28-12-7-9-14(10-8-12)34-13-5-3-2-4-6-13/h2-10H,1H3,(H5-,26,27,28,29,30,32,33) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(cc4)Oc5ccccc5)N)N)C#N | |
| AKOS005253570 | 499.501 | C24 H17 N7 O4 S | ILEUTTAHFAKQNX-UHFFFAOYSA-N | InChI=1S/C24H17N7O4S/c1-31-21(24(33)35-30-31)20-17(11-25)22(27)29-23(18(20)12-26)36-13-19(32)28-14-7-9-16(10-8-14)34-15-5-3-2-4-6-15/h2-10H,13H2,1H3,(H3-,27,28,29,30,32,33) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(cc3)Oc4ccccc4)N)C#N | |
| AKOS005254090 | 499.501 | C24 H17 N7 O4 S | NXEXIPWQNJLYQV-UHFFFAOYSA-N | InChI=1S/C24H17N7O4S/c1-11-4-3-5-15(28-11)16-14(10-25)22(27)29-23-17(16)18(26)21(36-23)20(32)19-24(33)35-30-31(19)12-6-8-13(34-2)9-7-12/h3-9H,1-2H3,(H4-,26,27,29,30,32,33) | Cc1cccc(n1)c2c(c(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N)N)C#N | |
| AKOS005250689 | 442.49 | C24 H18 N4 O3 S | BYJJTLODOTVIAE-UHFFFAOYSA-N | InChI=1S/C24H18N4O3S/c1-15-8-10-16(11-9-15)18-12-20(17-6-4-3-5-7-17)26-23(19(18)13-25)32-14-21(29)22-24(30)31-27-28(22)2/h3-12H,14H2,1-2H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)c3c(on[n+]3C)[O-])c4ccccc4 | |
| AKOS005253705 | 442.49 | C24 H18 N4 O3 S | NVCABIISURUTAS-UHFFFAOYSA-N | InChI=1S/C24H18N4O3S/c1-13-8-10-15(11-9-13)19-14(2)12-17-18(25)22(32-23(17)26-19)21(29)20-24(30)31-27-28(20)16-6-4-3-5-7-16/h3-12H,1-2H3,(H2-,25,27,29,30) | Cc1ccc(cc1)c2c(cc3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)C | |
| AKOS005253902 | 442.49 | C24 H18 N4 O3 S | SZWMYHQAWASHOG-UHFFFAOYSA-N | InChI=1S/C24H18N4O3S/c1-13-8-10-14(11-9-13)16-12-17(15-6-4-3-5-7-15)26-23-18(16)19(25)22(32-23)21(29)20-24(30)31-27-28(20)2/h3-12H,1-2H3,(H2-,25,27,29,30) | Cc1ccc(cc1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4C)[O-])N)c5ccccc5 | |
| AKOS005250477 | 458.489 | C24 H18 N4 O4 S | QXVOWKAFSIADAK-UHFFFAOYSA-N | InChI=1S/C24H18N4O4S/c1-15-3-5-16(6-4-15)20-12-7-17(13-25)23(26-20)33-14-21(29)22-24(30)32-27-28(22)18-8-10-19(31-2)11-9-18/h3-12H,14H2,1-2H3 | Cc1ccc(cc1)c2ccc(c(n2)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])C#N | |
| AKOS005250703 | 458.489 | C24 H18 N4 O4 S | ZGNXFVGRODQIGZ-UHFFFAOYSA-N | InChI=1S/C24H18N4O4S/c1-28-22(24(30)32-27-28)21(29)14-33-23-19(13-25)18(15-8-10-17(31-2)11-9-15)12-20(26-23)16-6-4-3-5-7-16/h3-12H,14H2,1-2H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2c(c(cc(n2)c3ccccc3)c4ccc(cc4)OC)C#N | |
| AKOS005251888 | 458.489 | C24 H18 N4 O4 S | DXIOJNSWOOKWAG-UHFFFAOYSA-N | InChI=1S/C24H18N4O4S/c1-15(33-23-24(30)32-27-28(23)18-7-3-2-4-8-18)21(29)25-17-13-11-16(12-14-17)22-26-19-9-5-6-10-20(19)31-22/h2-15H,1H3,(H-,25,26,27,29,30) | CC(C(=O)Nc1ccc(cc1)c2nc3ccccc3o2)Sc4c(on[n+]4c5ccccc5)[O-] | |
| AKOS005252159 | 458.489 | C24 H18 N4 O4 S | ZZZLSOCECBFCHC-UHFFFAOYSA-N | InChI=1S/C24H18N4O4S/c29-21(14-15-33-23-24(30)32-27-28(23)18-6-2-1-3-7-18)25-17-12-10-16(11-13-17)22-26-19-8-4-5-9-20(19)31-22/h1-13H,14-15H2,(H-,25,26,27,29,30) | c1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)c4nc5ccccc5o4 | |
| AKOS005253701 | 458.489 | C24 H18 N4 O4 S | LIDWNEIZKSJYKN-UHFFFAOYSA-N | InChI=1S/C24H18N4O4S/c1-13-3-5-14(6-4-13)18-12-11-17-19(25)22(33-23(17)26-18)21(29)20-24(30)32-27-28(20)15-7-9-16(31-2)10-8-15/h3-12H,1-2H3,(H2-,25,27,29,30) | Cc1ccc(cc1)c2ccc3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N | |
| AKOS005253729 | 458.489 | C24 H18 N4 O4 S | NGFRVSBXLHJRSU-UHFFFAOYSA-N | InChI=1S/C24H18N4O4S/c1-13-12-17-18(25)22(33-23(17)26-19(13)14-6-4-3-5-7-14)21(29)20-24(30)32-27-28(20)15-8-10-16(31-2)11-9-15/h3-12H,1-2H3,(H2-,25,27,29,30) | Cc1cc2c(c(sc2nc1c3ccccc3)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N | |
| AKOS005253858 | 458.489 | C24 H18 N4 O4 S | MWPNLYFPJKTTBX-UHFFFAOYSA-N | InChI=1S/C24H18N4O4S/c1-28-20(24(30)32-27-28)21(29)22-19(25)18-16(13-6-4-3-5-7-13)12-17(26-23(18)33-22)14-8-10-15(31-2)11-9-14/h3-12H,1-2H3,(H2-,25,27,29,30) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4ccc(cc4)OC)c5ccccc5)N | |
| AKOS005253696 | 490.554 | C24 H18 N4 O4 S2 | XDDBDNNIOJFMIR-UHFFFAOYSA-N | InChI=1S/C24H18N4O4S2/c1-11-9-10-15(33-11)17-16(13(3)29)12(2)26-23-18(17)19(25)22(34-23)21(30)20-24(31)32-27-28(20)14-7-5-4-6-8-14/h4-10H,1-3H3,(H2-,25,27,30,31) | Cc1ccc(s1)c2c3c(c(sc3nc(c2C(=O)C)C)C(=O)c4c(on[n+]4c5ccccc5)[O-])N | |
| AKOS005250476 | 474.489 | C24 H18 N4 O5 S | JDLJJGWARMMLIC-UHFFFAOYSA-N | InChI=1S/C24H18N4O5S/c1-31-18-8-3-15(4-9-18)20-12-5-16(13-25)23(26-20)34-14-21(29)22-24(30)33-27-28(22)17-6-10-19(32-2)11-7-17/h3-12H,14H2,1-2H3 | COc1ccc(cc1)c2ccc(c(n2)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])C#N | |
| AKOS005251583 | 474.489 | C24 H18 N4 O5 S | IHUKMYIHBMDTBE-UHFFFAOYSA-N | InChI=1S/C24H18N4O5S/c1-31-18-12-10-17(11-13-18)28-23(24(30)33-27-28)34-14-21(29)25-16-8-6-15(7-9-16)22-26-19-4-2-3-5-20(19)32-22/h2-13H,14H2,1H3,(H-,25,26,27,29,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3ccc(cc3)c4nc5ccccc5o4 | |
| AKOS005253750 | 474.489 | C24 H18 N4 O5 S | HQSNQICRRQWCIM-UHFFFAOYSA-N | InChI=1S/C24H18N4O5S/c1-31-15-7-3-13(4-8-15)18-12-11-17-19(25)22(34-23(17)26-18)21(29)20-24(30)33-27-28(20)14-5-9-16(32-2)10-6-14/h3-12H,1-2H3,(H2-,25,27,29,30) | COc1ccc(cc1)c2ccc3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N | |
| AKOS005253762 | 474.489 | C24 H18 N4 O5 S | OGZJREFSINUNGM-UHFFFAOYSA-N | InChI=1S/C24H18N4O5S/c1-31-15-8-6-14(7-9-15)28-20(24(30)33-27-28)21(29)22-19(25)17-10-11-18(26-23(17)34-22)13-4-3-5-16(12-13)32-2/h3-12H,1-2H3,(H2-,25,27,29,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4ccc(nc4s3)c5cccc(c5)OC)N | |
| AKOS005254086 | 474.489 | C24 H18 N4 O5 S | BINAIRAQTFJISX-UHFFFAOYSA-N | InChI=1S/C24H18N4O5S/c1-31-14-9-7-13(8-10-14)28-20(24(30)33-27-28)21(29)22-19(25)16-11-12-17(26-23(16)34-22)15-5-3-4-6-18(15)32-2/h3-12H,1-2H3,(H2-,25,27,29,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4ccc(nc4s3)c5ccccc5OC)N | |
| AKOS005254201 | 490.488 | C24 H18 N4 O6 S | NBRAZWIIMJVMET-UHFFFAOYSA-N | InChI=1S/C24H18N4O6S/c1-11-16(12(2)29)17(15-5-4-10-33-15)18-19(25)22(35-23(18)26-11)21(30)20-24(31)34-27-28(20)13-6-8-14(32-3)9-7-13/h4-10H,1-3H3,(H2-,25,27,30,31) | Cc1c(c(c2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N)c5ccco5)C(=O)C | |
| AKOS005252430 | 441.505 | C24 H19 N5 O2 S | CAUVHSRWWLBMPW-UHFFFAOYSA-N | InChI=1S/C24H19N5O2S/c1-2-29-15-23(31-28-29)27-22(30)16-32-24-20(14-25)19(17-9-5-3-6-10-17)13-21(26-24)18-11-7-4-8-12-18/h3-13,15H,2,16H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4ccccc4)C#N | |
| AKOS005252527 | 441.505 | C24 H19 N5 O2 S | IIMHNXSUSTXXRE-UHFFFAOYSA-N | InChI=1S/C24H19N5O2S/c1-16-8-10-17(11-9-16)19-12-21(18-6-4-3-5-7-18)26-24(20(19)13-25)32-15-22(30)27-23-14-29(2)28-31-23/h3-12,14H,15H2,1-2H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)C)c4ccccc4 | |
| AKOS005252406 | 457.504 | C24 H19 N5 O3 S | NRLXHITZISIFMW-UHFFFAOYSA-N | InChI=1S/C24H19N5O3S/c1-29-14-23(32-28-29)27-22(30)15-33-24-20(13-25)19(16-8-10-18(31-2)11-9-16)12-21(26-24)17-6-4-3-5-7-17/h3-12,14H,15H2,1-2H3 | C[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4ccc(cc4)OC)C#N | |
| AKOS005251038 | 441.439 | C24 H19 N5 O4 | LNHOUWCMXTWJPG-UHFFFAOYSA-O | InChI=1S/C24H18N5O4/c30-22(18-9-3-1-4-10-18)27-20(23(31)26-16-17-8-7-13-25-15-17)14-21-24(32)33-28-29(21)19-11-5-2-6-12-19/h1-15H,16H2,(H,26,31)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCc4cccnc4 | |
| AKOS005253852 | 473.504 | C24 H19 N5 O4 S | CTLPAMJKNNYBLN-UHFFFAOYSA-N | InChI=1S/C24H19N5O4S/c1-29-20(24(31)33-28-29)21(30)22-19(26)18-16(13-4-3-5-15(10-13)32-2)11-17(27-23(18)34-22)12-6-8-14(25)9-7-12/h3-11H,1-2H3,(H4-,25,26,27,28,30,31) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4ccc(cc4)N)c5cccc(c5)OC)N | |
| AKOS005251684 | 505.569 | C24 H19 N5 O4 S2 | WZMDBMVMQMMPSL-UHFFFAOYSA-N | InChI=1S/C24H19N5O4S2/c1-14-18(13-25)22(35-19(14)21(31)26-16-9-5-3-6-10-16)27-20(30)15(2)34-23-24(32)33-28-29(23)17-11-7-4-8-12-17/h3-12,15H,1-2H3,(H2-,26,27,28,30,31,32) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)C(C)Sc3c(on[n+]3c4ccccc4)[O-])C#N | |
| AKOS005252599 | 505.569 | C24 H19 N5 O4 S2 | WJYJIWZQOCUVRJ-UHFFFAOYSA-N | InChI=1S/C24H19N5O4S2/c1-15-18(14-25)22(35-20(15)21(31)26-16-8-4-2-5-9-16)27-19(30)12-13-34-23-24(32)33-28-29(23)17-10-6-3-7-11-17/h2-11H,12-13H2,1H3,(H2-,26,27,28,30,31,32) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])C#N | |
| AKOS005251391 | 521.568 | C24 H19 N5 O5 S2 | LIVPCCCGKPGEBL-UHFFFAOYSA-N | InChI=1S/C24H19N5O5S2/c1-14-18(12-25)22(36-20(14)21(31)26-15-6-4-3-5-7-15)27-19(30)13-35-23-24(32)34-28-29(23)16-8-10-17(33-2)11-9-16/h3-11H,13H2,1-2H3,(H2-,26,27,28,30,31,32) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])C#N | |
| AKOS005252977 | 542.97 | C24 H20 Cl F N6 O4 S | GEHJONAMUWMQPA-MOSHPQCFSA-N | InChI=1S/C24H20ClFN6O4S/c25-18-7-4-8-19(26)17(18)13-20-23(34)32(16-5-2-1-3-6-16)24(27-20)37-15-21(33)28-22-14-31(29-36-22)30-9-11-35-12-10-30/h1-8,13-14H,9-12,15H2/b20-13- | c1ccc(cc1)N2C(=O)/C(=C/c3c(cccc3Cl)F)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005252994 | 559.424 | C24 H20 Cl2 N6 O4 S | QKCHITXPMMKFSM-CPNJWEJPSA-N | InChI=1S/C24H20Cl2N6O4S/c25-18-8-4-5-16(22(18)26)13-19-23(34)32(17-6-2-1-3-7-17)24(27-19)37-15-20(33)28-21-14-31(29-36-21)30-9-11-35-12-10-30/h1-8,13-14H,9-12,15H2/b19-13+ | c1ccc(cc1)N2C(=O)/C(=C\c3cccc(c3Cl)Cl)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005253000 | 559.424 | C24 H20 Cl2 N6 O4 S | MQGCJDAWTRPKEF-UDWIEESQSA-N | InChI=1S/C24H20Cl2N6O4S/c25-17-7-6-16(19(26)13-17)12-20-23(34)32(18-4-2-1-3-5-18)24(27-20)37-15-21(33)28-22-14-31(29-36-22)30-8-10-35-11-9-30/h1-7,12-14H,8-11,15H2/b20-12+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccc(cc3Cl)Cl)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005253005 | 559.424 | C24 H20 Cl2 N6 O4 S | ZTSAQQAZPFDXFE-MOSHPQCFSA-N | InChI=1S/C24H20Cl2N6O4S/c25-18-7-4-8-19(26)17(18)13-20-23(34)32(16-5-2-1-3-6-16)24(27-20)37-15-21(33)28-22-14-31(29-36-22)30-9-11-35-12-10-30/h1-8,13-14H,9-12,15H2/b20-13- | c1ccc(cc1)N2C(=O)/C(=C/c3c(cccc3Cl)Cl)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005251361 | 444.506 | C24 H20 N4 O3 S | STZAWOKNFSVLHW-UHFFFAOYSA-N | InChI=1S/C24H20N4O3S/c1-26-20(23(29)31-25-26)16-27(15-17-9-3-2-4-10-17)24(30)28-18-11-5-7-13-21(18)32-22-14-8-6-12-19(22)28/h2-14H,15-16H2,1H3 | C[n+]1c(c(on1)[O-])CN(Cc2ccccc2)C(=O)N3c4ccccc4Sc5c3cccc5 | |
| AKOS005251093 | 476.504 | C24 H20 N4 O5 S | DNCWLTPOPAZRIF-UHFFFAOYSA-O | InChI=1S/C24H19N4O5S/c1-32-18-11-9-17(10-12-18)28-21(24(31)33-27-28)14-20(23(30)25-15-19-8-5-13-34-19)26-22(29)16-6-3-2-4-7-16/h2-14H,15H2,1H3,(H,25,30)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCc3cccs3)\NC(=O)c4ccccc4 | |
| AKOS005251099 | 460.439 | C24 H20 N4 O6 | XFWWGOLHYQQYKD-UHFFFAOYSA-O | InChI=1S/C24H19N4O6/c1-32-18-11-9-17(10-12-18)28-21(24(31)34-27-28)14-20(23(30)25-15-19-8-5-13-33-19)26-22(29)16-6-3-2-4-7-16/h2-14H,15H2,1H3,(H,25,30)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCc3ccco3)\NC(=O)c4ccccc4 | |
| AKOS005251613 | 524.569 | C24 H20 N4 O6 S2 | WXOQOQMUFYVRFA-UHFFFAOYSA-N | InChI=1S/C24H20N4O6S2/c1-14-18(23(31)33-2)21(36-19(14)20(30)25-15-9-5-3-6-10-15)26-17(29)13-35-22-24(32)34-27-28(22)16-11-7-4-8-12-16/h3-12H,13H2,1-2H3,(H2-,25,26,27,29,30,31,32) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])C(=O)OC | |
| AKOS005250204 | 508.503 | C24 H20 N4 O7 S | HUQIJAXCPSWLFC-UHFFFAOYSA-N | InChI=1S/C24H20N4O7S/c1-13-17(23(31)34-3)22(36-19(13)21(30)25-14-7-5-4-6-8-14)26-20(29)18-24(32)35-27-28(18)15-9-11-16(33-2)12-10-15/h4-12H,1-3H3,(H2-,25,26,27,29,30,31,32) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])C(=O)OC | |
| AKOS005252728 | 456.52 | C24 H20 N6 O2 S | VNHWKCMUAWGFKP-UHFFFAOYSA-N | InChI=1S/C24H20N6O2S/c1-29(2)30-15-23(32-28-30)27-22(31)16-33-24-20(14-25)19(17-9-5-3-6-10-17)13-21(26-24)18-11-7-4-8-12-18/h3-13,15H,16H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4ccccc4)C#N | |
| AKOS005252996 | 569.43 | C24 H21 Br N6 O4 S | NTHGBMQJACVOOD-XSFVSMFZSA-N | InChI=1S/C24H21BrN6O4S/c25-18-6-4-5-17(13-18)14-20-23(33)31(19-7-2-1-3-8-19)24(26-20)36-16-21(32)27-22-15-30(28-35-22)29-9-11-34-12-10-29/h1-8,13-15H,9-12,16H2/b20-14+ | c1ccc(cc1)N2C(=O)/C(=C\c3cccc(c3)Br)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005252997 | 569.43 | C24 H21 Br N6 O4 S | RTCSIAHBOZDBCY-XSFVSMFZSA-N | InChI=1S/C24H21BrN6O4S/c25-18-8-6-17(7-9-18)14-20-23(33)31(19-4-2-1-3-5-19)24(26-20)36-16-21(32)27-22-15-30(28-35-22)29-10-12-34-13-11-29/h1-9,14-15H,10-13,16H2/b20-14+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccc(cc3)Br)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005252978 | 524.979 | C24 H21 Cl N6 O4 S | WPRWXTNXBCPLEZ-XSFVSMFZSA-N | InChI=1S/C24H21ClN6O4S/c25-19-9-5-4-6-17(19)14-20-23(33)31(18-7-2-1-3-8-18)24(26-20)36-16-21(32)27-22-15-30(28-35-22)29-10-12-34-13-11-29/h1-9,14-15H,10-13,16H2/b20-14+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccccc3Cl)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005252983 | 524.979 | C24 H21 Cl N6 O4 S | PFSZMKSXQHTYOL-XSFVSMFZSA-N | InChI=1S/C24H21ClN6O4S/c25-18-6-4-5-17(13-18)14-20-23(33)31(19-7-2-1-3-8-19)24(26-20)36-16-21(32)27-22-15-30(28-35-22)29-9-11-34-12-10-29/h1-8,13-15H,9-12,16H2/b20-14+ | c1ccc(cc1)N2C(=O)/C(=C\c3cccc(c3)Cl)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005252984 | 524.979 | C24 H21 Cl N6 O4 S | QNWQEEAIEDRLQG-XSFVSMFZSA-N | InChI=1S/C24H21ClN6O4S/c25-18-8-6-17(7-9-18)14-20-23(33)31(19-4-2-1-3-5-19)24(26-20)36-16-21(32)27-22-15-30(28-35-22)29-10-12-34-13-11-29/h1-9,14-15H,10-13,16H2/b20-14+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccc(cc3)Cl)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005253006 | 508.525 | C24 H21 F N6 O4 S | UUUHVIJHGRJRHC-XSFVSMFZSA-N | InChI=1S/C24H21FN6O4S/c25-19-9-5-4-6-17(19)14-20-23(33)31(18-7-2-1-3-8-18)24(26-20)36-16-21(32)27-22-15-30(28-35-22)29-10-12-34-13-11-29/h1-9,14-15H,10-13,16H2/b20-14+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccccc3F)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005253007 | 508.525 | C24 H21 F N6 O4 S | BWSMTXOXJNOTFM-XSFVSMFZSA-N | InChI=1S/C24H21FN6O4S/c25-18-8-6-17(7-9-18)14-20-23(33)31(19-4-2-1-3-5-19)24(26-20)36-16-21(32)27-22-15-30(28-35-22)29-10-12-34-13-11-29/h1-9,14-15H,10-13,16H2/b20-14+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccc(cc3)F)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCOCC5 | |
| AKOS005254040 | 562.521 | C24 H21 F3 N6 O5 S | STZBNBAGZNMIFZ-UHFFFAOYSA-N | InChI=1S/C24H21F3N6O5S/c1-31-22(36)17(12-19(34)28-15-8-10-16(11-9-15)37-24(25,26)27)33(23(31)39)13-18-21(38-30-32(18)2)29-20(35)14-6-4-3-5-7-14/h3-11,17H,12-13H2,1-2H3,(H-,28,29,30,34,35) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)OC(F)(F)F | |
| AKOS005250306 | 415.441 | C24 H21 N3 O4 | OQWFFQZSOSRPMA-UHFFFAOYSA-N | InChI=1S/C24H21N3O4/c1-30-21-12-10-20(11-13-21)27-22(24(29)31-25-27)15-26(19-8-9-19)23(28)18-7-6-16-4-2-3-5-17(16)14-18/h2-7,10-14,19H,8-9,15H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)c4ccc5ccccc5c4 | |
| AKOS005252073 | 447.506 | C24 H21 N3 O4 S | JDSGZHDZFNUZAP-UHFFFAOYSA-N | InChI=1S/C24H21N3O4S/c1-2-21(32-23-24(29)31-26-27(23)18-9-5-3-6-10-18)22(28)25-17-13-15-20(16-14-17)30-19-11-7-4-8-12-19/h3-16,21H,2H2,1H3,(H-,25,26,28,29) | CCC(C(=O)Nc1ccc(cc1)Oc2ccccc2)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251806 | 463.506 | C24 H21 N3 O5 S | CNRDQLUIAHHHLN-UHFFFAOYSA-N | InChI=1S/C24H21N3O5S/c1-16(33-23-24(29)32-26-27(23)18-10-14-19(30-2)15-11-18)22(28)25-17-8-12-21(13-9-17)31-20-6-4-3-5-7-20/h3-16H,1-2H3,(H-,25,26,28,29) | CC(C(=O)Nc1ccc(cc1)Oc2ccccc2)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252235 | 463.506 | C24 H21 N3 O5 S | OVMHVNXDWHNLEK-UHFFFAOYSA-N | InChI=1S/C24H21N3O5S/c1-30-19-13-9-18(10-14-19)27-23(24(29)32-26-27)33-16-15-22(28)25-17-7-11-21(12-8-17)31-20-5-3-2-4-6-20/h2-14H,15-16H2,1H3,(H-,25,26,28,29) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)Oc4ccccc4 | |
| AKOS005252909 | 459.52 | C24 H21 N5 O3 S | ZCHRRUURGGDRLI-NSWHACQGSA-N | InChI=1S/C24H21N5O3S/c1-2-28-16-22(32-27-28)26-21(30)17-33-24-25-20(15-9-12-18-10-5-3-6-11-18)23(31)29(24)19-13-7-4-8-14-19/h3-16H,2,17H2,1H3/b12-9+,20-15+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/C=C/c3ccccc3)/C(=O)N2c4ccccc4 | |
| AKOS005251347 | 459.454 | C24 H21 N5 O5 | XXFDIBMHUYRPKT-UHFFFAOYSA-N | InChI=1S/C24H21N5O5/c1-27-19(24(32)34-26-27)13-28(15-10-11-15)18-12-21(30)29(23(18)31)16-8-6-14(7-9-16)22-25-17-4-2-3-5-20(17)33-22/h2-9,15,18H,10-13H2,1H3 | C[n+]1c(c(on1)[O-])CN(C2CC2)C3CC(=O)N(C3=O)c4ccc(cc4)c5nc6ccccc6o5 | |
| AKOS005252791 | 491.519 | C24 H21 N5 O5 S | WIDGBZROMLOEKC-VCHYOVAHSA-N | InChI=1S/C24H21N5O5S/c1-15(2)28-12-22(34-27-28)26-21(30)13-35-24-25-18(23(31)29(24)17-6-4-3-5-7-17)10-16-8-9-19-20(11-16)33-14-32-19/h3-12,15H,13-14H2,1-2H3/b18-10+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc4c(c3)OCO4)/C(=O)N2c5ccccc5 | |
| AKOS005253374 | 507.518 | C24 H21 N5 O6 S | YTBGXPNMJQXOCN-WOJGMQOQSA-N | InChI=1S/C24H21N5O6S/c1-32-10-9-28-13-22(35-27-28)26-21(30)14-36-24-25-18(23(31)29(24)17-5-3-2-4-6-17)11-16-7-8-19-20(12-16)34-15-33-19/h2-8,11-13H,9-10,14-15H2,1H3/b18-11+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc4c(c3)OCO4)/C(=O)N2c5ccccc5 | |
| AKOS005253809 | 565.522 | C24 H22 F3 N5 O6 S | USQQRBNTMXGXGL-UHFFFAOYSA-N | InChI=1S/C24H22F3N5O6S/c1-3-36-16-10-6-15(7-11-16)32-21(34)18(31(23(32)39)13-19-22(35)38-29-30(19)2)12-20(33)28-14-4-8-17(9-5-14)37-24(25,26)27/h4-11,18H,3,12-13H2,1-2H3,(H-,28,29,33,35) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)OC(F)(F)F | |
| AKOS005215659 | 415.424 | C24 H22 N3 O2 P | NECJSCLIZHXWSE-UHFFFAOYSA-N | InChI=1S/C24H22N3O2P/c1-18(2)27-24(23(29-26-27)25-22(28)19-12-6-3-7-13-19)30(20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-18H,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)c2ccccc2)P(c3ccccc3)c4ccccc4 | |
| AKOS005219852 | 446.521 | C24 H22 N4 O3 S | ZUQMUWSOSQNZNN-UHFFFAOYSA-N | InChI=1S/C24H22N4O3S/c1-30-21-14-12-20(13-15-21)28-22(23(29)31-26-28)17-27(16-18-8-4-2-5-9-18)24(32)25-19-10-6-3-7-11-19/h2-15H,16-17H2,1H3,(H-,25,26,29,32) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(Cc3ccccc3)C(=S)Nc4ccccc4 | |
| AKOS005250723 | 462.521 | C24 H22 N4 O4 S | ZZSBWEHVZKVBNZ-CPNJWEJPSA-N | InChI=1S/C24H22N4O4S/c1-15(2)17-11-9-16(10-12-17)13-19-22(30)28(18-7-5-4-6-8-18)24(25-19)33-14-20(29)21-23(31)32-26-27(21)3/h4-13,15H,14H2,1-3H3/b19-13+ | CC(C)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3C)[O-])c4ccccc4 | |
| AKOS005251363 | 446.455 | C24 H22 N4 O5 | ASUBBTMILVPJOR-UHFFFAOYSA-N | InChI=1S/C24H22N4O5/c1-15(29)16-7-9-18(10-8-16)27-22(30)13-20(23(27)31)26(17-11-12-17)14-21-24(32)33-25-28(21)19-5-3-2-4-6-19/h2-10,17,20H,11-14H2,1H3 | CC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)N(Cc3c(on[n+]3c4ccccc4)[O-])C5CC5 | |
| AKOS005251079 | 510.519 | C24 H22 N4 O7 S | PAOROZHJHRBZBH-MHWRWJLKSA-N | InChI=1S/C24H22N4O7S/c1-27-21(23(31)35-26-27)17(29)13-36-24-25-16(22(30)28(24)15-8-6-5-7-9-15)10-14-11-19(33-3)20(34-4)12-18(14)32-2/h5-12H,13H2,1-4H3/b16-10+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3cc(c(cc3OC)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005251080 | 510.519 | C24 H22 N4 O7 S | ZEWGEYUBVXJDPY-MHWRWJLKSA-N | InChI=1S/C24H22N4O7S/c1-27-20(23(31)35-26-27)17(29)13-36-24-25-16(22(30)28(24)15-8-6-5-7-9-15)10-14-11-18(32-2)21(34-4)19(12-14)33-3/h5-12H,13H2,1-4H3/b16-10+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3cc(c(c(c3)OC)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252770 | 474.535 | C24 H22 N6 O3 S | SXZOPOZNVRKXAY-NSWHACQGSA-N | InChI=1S/C24H22N6O3S/c1-28(2)29-16-22(33-27-29)26-21(31)17-34-24-25-20(15-9-12-18-10-5-3-6-11-18)23(32)30(24)19-13-7-4-8-14-19/h3-16H,17H2,1-2H3/b12-9+,20-15+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/C=C/c3ccccc3)/C(=O)N2c4ccccc4 | |
| AKOS005253002 | 490.534 | C24 H22 N6 O4 S | SQKZWXFWUBZVSY-HMMYKYKNSA-N | InChI=1S/C24H22N6O4S/c31-21(26-22-16-29(27-34-22)28-11-13-33-14-12-28)17-35-24-25-20(15-18-7-3-1-4-8-18)23(32)30(24)19-9-5-2-6-10-19/h1-10,15-16H,11-14,17H2/b20-15+ | c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005253505 | 522.599 | C24 H22 N6 O4 S2 | ZTUKWERZLDPAGI-UHFFFAOYSA-N | InChI=1S/C24H22N6O4S2/c1-13-4-9-16-19(10-13)36-21(26-16)14-5-7-15(8-6-14)25-20(31)11-17-22(32)28(2)24(35)30(17)12-18-23(33)34-27-29(18)3/h4-10,17H,11-12H2,1-3H3,(H-,25,26,27,31,33) | Cc1ccc2c(c1)sc(n2)c3ccc(cc3)NC(=O)CC4C(=O)N(C(=S)N4Cc5c(on[n+]5C)[O-])C | |
| AKOS005253499 | 506.534 | C24 H22 N6 O5 S | LSVKTRIRJUBKQX-UHFFFAOYSA-N | InChI=1S/C24H22N6O5S/c1-3-29-22(32)17(30(24(29)36)13-18-23(33)35-27-28(18)2)12-20(31)25-15-10-8-14(9-11-15)21-26-16-6-4-5-7-19(16)34-21/h4-11,17H,3,12-13H2,1-2H3,(H-,25,26,27,31,33) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)c4nc5ccccc5o4 | |
| AKOS005254007 | 571.446 | C24 H23 Br N6 O4 S | PMLTWINJWQJCOO-UHFFFAOYSA-N | InChI=1S/C24H23BrN6O4S/c1-3-30-23(34)18(13-20(32)26-17-11-9-16(25)10-12-17)31(24(30)36)14-19-22(35-28-29(19)2)27-21(33)15-7-5-4-6-8-15/h4-12,18H,3,13-14H2,1-2H3,(H-,26,27,28,32,33) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)Br | |
| AKOS005254006 | 526.995 | C24 H23 Cl N6 O4 S | VESKFBSMFKWTMD-UHFFFAOYSA-N | InChI=1S/C24H23ClN6O4S/c1-3-30-23(34)18(13-20(32)26-17-11-9-16(25)10-12-17)31(24(30)36)14-19-22(35-28-29(19)2)27-21(33)15-7-5-4-6-8-15/h4-12,18H,3,13-14H2,1-2H3,(H-,26,27,28,32,33) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)Cl | |
| AKOS005254012 | 510.541 | C24 H23 F N6 O4 S | VHLBMWNNEOMBHL-UHFFFAOYSA-N | InChI=1S/C24H23FN6O4S/c1-3-30-23(34)18(13-20(32)26-17-11-9-16(25)10-12-17)31(24(30)36)14-19-22(35-28-29(19)2)27-21(33)15-7-5-4-6-8-15/h4-12,18H,3,13-14H2,1-2H3,(H-,26,27,28,32,33) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)F | |
| AKOS005254121 | 612.601 | C24 H23 F3 N6 O6 S2 | XLFJGCKLRSCQPO-UHFFFAOYSA-N | InChI=1S/C24H23F3N6O6S2/c1-14-4-10-17(11-5-14)41(36,37)29-21-19(32(3)30-39-21)13-33-18(22(35)31(2)23(33)40)12-20(34)28-15-6-8-16(9-7-15)38-24(25,26)27/h4-11,18H,12-13H2,1-3H3,(H-,28,29,30,34) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)OC(F)(F)F | |
| AKOS005254011 | 618.447 | C24 H23 I N6 O4 S | NMXDRZKTBCLYPG-UHFFFAOYSA-N | InChI=1S/C24H23IN6O4S/c1-3-30-23(34)18(13-20(32)26-17-11-9-16(25)10-12-17)31(24(30)36)14-19-22(35-28-29(19)2)27-21(33)15-7-5-4-6-8-15/h4-12,18H,3,13-14H2,1-2H3,(H-,26,27,28,32,33) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)I | |
| AKOS005252484 | 461.536 | C24 H23 N5 O3 S | MQZOEFJWQNJQTF-DEDYPNTBSA-N | InChI=1S/C24H23N5O3S/c1-16(2)18-11-9-17(10-12-18)13-20-23(31)29(19-7-5-4-6-8-19)24(25-20)33-15-21(30)26-22-14-28(3)27-32-22/h4-14,16H,15H2,1-3H3/b20-13+ | CC(C)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)C)c4ccccc4 | |
| AKOS005252783 | 461.536 | C24 H23 N5 O3 S | HMNPRSRVDINNTH-DEDYPNTBSA-N | InChI=1S/C24H23N5O3S/c1-16(2)28-14-22(32-27-28)26-21(30)15-33-24-25-20(13-18-10-8-7-9-17(18)3)23(31)29(24)19-11-5-4-6-12-19/h4-14,16H,15H2,1-3H3/b20-13+ | Cc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)C(C)C)c4ccccc4 | |
| AKOS005252784 | 461.536 | C24 H23 N5 O3 S | OPIDFWBNQMDQMK-DEDYPNTBSA-N | InChI=1S/C24H23N5O3S/c1-16(2)28-14-22(32-27-28)26-21(30)15-33-24-25-20(13-18-9-7-8-17(3)12-18)23(31)29(24)19-10-5-4-6-11-19/h4-14,16H,15H2,1-3H3/b20-13+ | Cc1cccc(c1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)C(C)C)c4ccccc4 | |
| AKOS005252792 | 461.536 | C24 H23 N5 O3 S | GUWQFXBTXGAKRY-DEDYPNTBSA-N | InChI=1S/C24H23N5O3S/c1-16(2)28-14-22(32-27-28)26-21(30)15-33-24-25-20(13-18-11-9-17(3)10-12-18)23(31)29(24)19-7-5-4-6-8-19/h4-14,16H,15H2,1-3H3/b20-13+ | Cc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)C(C)C)c4ccccc4 | |
| AKOS005252865 | 477.536 | C24 H23 N5 O4 S | KREDENWKRJDCOK-DEDYPNTBSA-N | InChI=1S/C24H23N5O4S/c1-16(2)28-14-22(33-27-28)26-21(30)15-34-24-25-20(13-17-9-11-19(32-3)12-10-17)23(31)29(24)18-7-5-4-6-8-18/h4-14,16H,15H2,1-3H3/b20-13+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252889 | 477.536 | C24 H23 N5 O4 S | YESAKYJUTKABHG-CPNJWEJPSA-N | InChI=1S/C24H23N5O4S/c1-16(2)28-14-22(33-27-28)26-21(30)15-34-24-25-19(13-17-9-7-8-12-20(17)32-3)23(31)29(24)18-10-5-4-6-11-18/h4-14,16H,15H2,1-3H3/b19-13+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3OC)/C(=O)N2c4ccccc4 | |
| AKOS005252890 | 477.536 | C24 H23 N5 O4 S | SAOFMLQJFOMLDP-DEDYPNTBSA-N | InChI=1S/C24H23N5O4S/c1-16(2)28-14-22(33-27-28)26-21(30)15-34-24-25-20(13-17-8-7-11-19(12-17)32-3)23(31)29(24)18-9-5-4-6-10-18/h4-14,16H,15H2,1-3H3/b20-13+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252914 | 477.536 | C24 H23 N5 O4 S | MYWUBHAFKZQUFC-XMHGGMMESA-N | InChI=1S/C24H23N5O4S/c1-3-28-15-22(33-27-28)26-21(30)16-34-24-25-19(14-17-10-8-9-13-20(17)32-4-2)23(31)29(24)18-11-6-5-7-12-18/h5-15H,3-4,16H2,1-2H3/b19-14+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3OCC)/C(=O)N2c4ccccc4 | |
| AKOS005252921 | 477.536 | C24 H23 N5 O4 S | YXACRDKVXZKYHN-XSFVSMFZSA-N | InChI=1S/C24H23N5O4S/c1-3-28-15-22(33-27-28)26-21(30)16-34-24-25-20(14-17-10-12-19(13-11-17)32-4-2)23(31)29(24)18-8-6-5-7-9-18/h5-15H,3-4,16H2,1-2H3/b20-14+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)OCC)/C(=O)N2c4ccccc4 | |
| AKOS005253329 | 477.536 | C24 H23 N5 O4 S | MJXAEBRRPZDSFL-XSFVSMFZSA-N | InChI=1S/C24H23N5O4S/c1-17-8-6-7-9-18(17)14-20-23(31)29(19-10-4-3-5-11-19)24(25-20)34-16-21(30)26-22-15-28(27-33-22)12-13-32-2/h3-11,14-15H,12-13,16H2,1-2H3/b20-14+ | Cc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)CCOC)c4ccccc4 | |
| AKOS005253330 | 477.536 | C24 H23 N5 O4 S | QDWCGQZJTSWPNU-XSFVSMFZSA-N | InChI=1S/C24H23N5O4S/c1-17-7-6-8-18(13-17)14-20-23(31)29(19-9-4-3-5-10-19)24(25-20)34-16-21(30)26-22-15-28(27-33-22)11-12-32-2/h3-10,13-15H,11-12,16H2,1-2H3/b20-14+ | Cc1cccc(c1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)CCOC)c4ccccc4 | |
| AKOS005253337 | 477.536 | C24 H23 N5 O4 S | SMYIFOXYVYXVKG-XSFVSMFZSA-N | InChI=1S/C24H23N5O4S/c1-17-8-10-18(11-9-17)14-20-23(31)29(19-6-4-3-5-7-19)24(25-20)34-16-21(30)26-22-15-28(27-33-22)12-13-32-2/h3-11,14-15H,12-13,16H2,1-2H3/b20-14+ | Cc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)CCOC)c4ccccc4 | |
| AKOS005253497 | 477.536 | C24 H23 N5 O4 S | HMDCDWDFFCJBLL-CMDGGOBGSA-N | InChI=1S/C24H23N5O4S/c1-27-22(31)19(29(24(27)34)15-20-23(32)33-26-28(20)2)14-21(30)25-18-12-10-17(11-13-18)9-8-16-6-4-3-5-7-16/h3-13,19H,14-15H2,1-2H3,(H-,25,26,30,32)/b9-8+ | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C)CC(=O)Nc3ccc(cc3)/C=C/c4ccccc4 | |
| AKOS005250903 | 461.47 | C24 H23 N5 O5 | DIYKIQIWAOVNII-UHFFFAOYSA-O | InChI=1S/C24H22N5O5/c1-27-20(24(33)34-26-27)11-18(25-22(31)16-6-3-2-4-7-16)23(32)28-12-15-10-17(14-28)19-8-5-9-21(30)29(19)13-15/h2-9,11,15,17H,10,12-14H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CC3CC(C2)c4cccc(=O)n4C3)\NC(=O)c5ccccc5 | |
| AKOS005250968 | 461.47 | C24 H23 N5 O5 | UZVBZRWVFXTPAK-UHFFFAOYSA-O | InChI=1S/C24H22N5O5/c25-21(30)16-11-13-28(14-12-16)23(32)19(26-22(31)17-7-3-1-4-8-17)15-20-24(33)34-27-29(20)18-9-5-2-6-10-18/h1-10,15-16H,11-14H2,(H2,25,30)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CCC(CC4)C(=O)N | |
| AKOS005250975 | 461.47 | C24 H23 N5 O5 | HREBWSURODCCSR-UHFFFAOYSA-O | InChI=1S/C24H22N5O5/c25-21(30)17-10-7-13-28(15-17)23(32)19(26-22(31)16-8-3-1-4-9-16)14-20-24(33)34-27-29(20)18-11-5-2-6-12-18/h1-6,8-9,11-12,14,17H,7,10,13,15H2,(H2,25,30)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CCCC(C4)C(=O)N | |
| AKOS005251034 | 461.47 | C24 H23 N5 O5 | UWQDNPJUHODTSM-UHFFFAOYSA-O | InChI=1S/C24H22N5O5/c1-17(30)27-12-14-28(15-13-27)23(32)20(25-22(31)18-8-4-2-5-9-18)16-21-24(33)34-26-29(21)19-10-6-3-7-11-19/h2-11,16H,12-15H2,1H3/q-1/p+1 | CC(=O)N1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251379 | 461.47 | C24 H23 N5 O5 | XHIMGACQAHYILY-UHFFFAOYSA-N | InChI=1S/C24H23N5O5/c1-15(30)25-16-7-9-18(10-8-16)28-22(31)13-20(23(28)32)27(17-11-12-17)14-21-24(33)34-26-29(21)19-5-3-2-4-6-19/h2-10,17,20H,11-14H2,1H3,(H-,25,26,30,33) | CC(=O)Nc1ccc(cc1)N2C(=O)CC(C2=O)N(Cc3c(on[n+]3c4ccccc4)[O-])C5CC5 | |
| AKOS005252912 | 493.535 | C24 H23 N5 O5 S | YAEFGISSGJYZLI-QGOAFFKASA-N | InChI=1S/C24H23N5O5S/c1-4-28-14-21(34-27-28)26-20(30)15-35-24-25-18(23(31)29(24)17-10-6-5-7-11-17)13-16-9-8-12-19(32-2)22(16)33-3/h5-14H,4,15H2,1-3H3/b18-13+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252919 | 493.535 | C24 H23 N5 O5 S | XPTWCFZEWQSQFT-XDHOZWIPSA-N | InChI=1S/C24H23N5O5S/c1-4-28-14-22(34-27-28)26-21(30)15-35-24-25-19(23(31)29(24)17-8-6-5-7-9-17)12-16-10-11-18(32-2)13-20(16)33-3/h5-14H,4,15H2,1-3H3/b19-12+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252920 | 493.535 | C24 H23 N5 O5 S | NBKPOMYAJBJZQD-CPNJWEJPSA-N | InChI=1S/C24H23N5O5S/c1-4-28-14-22(34-27-28)26-21(30)15-35-24-25-19(23(31)29(24)17-8-6-5-7-9-17)13-16-12-18(32-2)10-11-20(16)33-3/h5-14H,4,15H2,1-3H3/b19-13+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cc(ccc3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252927 | 493.535 | C24 H23 N5 O5 S | FMNGGOGVULHGAC-LDADJPATSA-N | InChI=1S/C24H23N5O5S/c1-4-28-14-22(34-27-28)26-21(30)15-35-24-25-18(23(31)29(24)17-8-6-5-7-9-17)12-16-10-11-19(32-2)20(13-16)33-3/h5-14H,4,15H2,1-3H3/b18-12+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(c(c3)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253336 | 493.535 | C24 H23 N5 O5 S | BEGUYTVTNCHBEK-XSFVSMFZSA-N | InChI=1S/C24H23N5O5S/c1-32-13-12-28-15-22(34-27-28)26-21(30)16-35-24-25-20(14-17-8-10-19(33-2)11-9-17)23(31)29(24)18-6-4-3-5-7-18/h3-11,14-15H,12-13,16H2,1-2H3/b20-14+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253343 | 493.535 | C24 H23 N5 O5 S | TVRJSELGZBSWNJ-XMHGGMMESA-N | InChI=1S/C24H23N5O5S/c1-32-13-12-28-15-22(34-27-28)26-21(30)16-35-24-25-19(14-17-8-6-7-11-20(17)33-2)23(31)29(24)18-9-4-3-5-10-18/h3-11,14-15H,12-13,16H2,1-2H3/b19-14+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccccc3OC)/C(=O)N2c4ccccc4 | |
| AKOS005253344 | 493.535 | C24 H23 N5 O5 S | BNTWUMCFUWKCLL-XSFVSMFZSA-N | InChI=1S/C24H23N5O5S/c1-32-12-11-28-15-22(34-27-28)26-21(30)16-35-24-25-20(14-17-7-6-10-19(13-17)33-2)23(31)29(24)18-8-4-3-5-9-18/h3-10,13-15H,11-12,16H2,1-2H3/b20-14+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253622 | 493.535 | C24 H23 N5 O5 S | LGDPKPFLHFISQI-UHFFFAOYSA-N | InChI=1S/C24H23N5O5S/c1-14-3-8-17-20(11-14)35-22(26-17)15-4-6-16(7-5-15)25-21(30)12-19-23(31)29(9-10-33-19)13-18-24(32)34-27-28(18)2/h3-8,11,19H,9-10,12-13H2,1-2H3,(H-,25,26,27,30,32) | Cc1ccc2c(c1)sc(n2)c3ccc(cc3)NC(=O)CC4C(=O)N(CCO4)Cc5c(on[n+]5C)[O-] | |
| AKOS005253827 | 493.535 | C24 H23 N5 O5 S | CSSNTNWOMMQSFQ-UHFFFAOYSA-N | InChI=1S/C24H23N5O5S/c1-14-4-10-18(11-5-14)29-22(32)19(28(24(29)35)13-20-23(33)34-26-27(20)3)12-21(31)25-17-8-6-16(7-9-17)15(2)30/h4-11,19H,12-13H2,1-3H3,(H-,25,26,30,31,33) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)C(=O)C | |
| AKOS005251258 | 477.469 | C24 H23 N5 O6 | MIKFJFOENNUANX-UHFFFAOYSA-N | InChI=1S/C24H23N5O6/c1-34-18-10-8-17(9-11-18)29-20(24(33)35-26-29)13-27(15-6-7-15)19-12-21(30)28(23(19)32)16-4-2-14(3-5-16)22(25)31/h2-5,8-11,15,19H,6-7,12-13H2,1H3,(H2-,25,26,31,33) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C4CC(=O)N(C4=O)c5ccc(cc5)C(=O)N | |
| AKOS005252442 | 509.534 | C24 H23 N5 O6 S | GAOGUTDURXLLDU-LICLKQGHSA-N | InChI=1S/C24H23N5O6S/c1-28-13-22(35-27-28)26-21(30)14-36-24-25-17(23(31)29(24)16-8-6-5-7-9-16)10-15-11-19(33-3)20(34-4)12-18(15)32-2/h5-13H,14H2,1-4H3/b17-10+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cc(c(cc3OC)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252443 | 509.534 | C24 H23 N5 O6 S | RIJPMCVEPWEFRV-LICLKQGHSA-N | InChI=1S/C24H23N5O6S/c1-28-13-21(35-27-28)26-20(30)14-36-24-25-17(23(31)29(24)16-8-6-5-7-9-16)10-15-11-18(32-2)22(34-4)19(12-15)33-3/h5-13H,14H2,1-4H3/b17-10+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cc(c(c(c3)OC)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253806 | 509.534 | C24 H23 N5 O6 S | LIPCRTMCNAQNJY-UHFFFAOYSA-N | InChI=1S/C24H23N5O6S/c1-3-34-22(32)15-9-11-16(12-10-15)25-20(30)13-18-21(31)29(17-7-5-4-6-8-17)24(36)28(18)14-19-23(33)35-26-27(19)2/h4-12,18H,3,13-14H2,1-2H3,(H-,25,26,30,32,33) | CCOC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])c4ccccc4 | |
| AKOS005253828 | 509.534 | C24 H23 N5 O6 S | KSHPOIWAXZZTHA-UHFFFAOYSA-N | InChI=1S/C24H23N5O6S/c1-14-4-10-17(11-5-14)29-21(31)18(28(24(29)36)13-19-23(33)35-26-27(19)2)12-20(30)25-16-8-6-15(7-9-16)22(32)34-3/h4-11,18H,12-13H2,1-3H3,(H-,25,26,30,32,33) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)C(=O)OC | |
| AKOS005253143 | 473.55 | C24 H23 N7 O2 S | JDBXFFPVLSRIJR-UHFFFAOYSA-N | InChI=1S/C24H23N7O2S/c32-20(25-21-16-31(29-33-21)30-14-8-3-9-15-30)17-34-24-26-22(18-10-4-1-5-11-18)23(27-28-24)19-12-6-2-7-13-19/h1-2,4-7,10-13,16H,3,8-9,14-15,17H2 | c1ccc(cc1)c2c(nnc(n2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005253074 | 489.55 | C24 H23 N7 O3 S | PIAVEJUZWBQFFR-HMMYKYKNSA-N | InChI=1S/C24H23N7O3S/c32-21(27-22-16-30(28-34-22)29-13-7-2-8-14-29)17-35-24-26-20(15-18-9-5-6-12-25-18)23(33)31(24)19-10-3-1-4-11-19/h1,3-6,9-12,15-16H,2,7-8,13-14,17H2/b20-15+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccccn3)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005253080 | 489.55 | C24 H23 N7 O3 S | OPRFLXDAMJMUMY-XSFVSMFZSA-N | InChI=1S/C24H23N7O3S/c32-21(27-22-16-30(28-34-22)29-12-5-2-6-13-29)17-35-24-26-20(14-18-8-7-11-25-15-18)23(33)31(24)19-9-3-1-4-10-19/h1,3-4,7-11,14-16H,2,5-6,12-13,17H2/b20-14+ | c1ccc(cc1)N2C(=O)/C(=C\c3cccnc3)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005253081 | 489.55 | C24 H23 N7 O3 S | GUCLWYVXNYQZIW-HMMYKYKNSA-N | InChI=1S/C24H23N7O3S/c32-21(27-22-16-30(28-34-22)29-13-5-2-6-14-29)17-35-24-26-20(15-18-9-11-25-12-10-18)23(33)31(24)19-7-3-1-4-8-19/h1,3-4,7-12,15-16H,2,5-6,13-14,17H2/b20-15+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccncc3)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005253226 | 521.548 | C24 H23 N7 O5 S | LVHYUPMRRIIJLP-UHFFFAOYSA-N | InChI=1S/C24H23N7O5S/c1-4-5-10-35-23(33)14-6-8-15(9-7-14)28-21(32)13(2)37-22-17(12-26)18(16(11-25)20(27)29-22)19-24(34)36-30-31(19)3/h6-9,13H,4-5,10H2,1-3H3,(H3-,27,28,29,30,32,33,34) | CCCCOC(=O)c1ccc(cc1)NC(=O)C(C)Sc2c(c(c(c(n2)N)C#N)c3c(on[n+]3C)[O-])C#N | |
| AKOS005253935 | 521.548 | C24 H23 N7 O5 S | QGAQHXYRCLFSCG-UHFFFAOYSA-N | InChI=1S/C24H23N7O5S/c1-29-23(35)17(12-19(32)26-16-10-8-14(9-11-16)20(25)33)31(24(29)37)13-18-22(36-28-30(18)2)27-21(34)15-6-4-3-5-7-15/h3-11,17H,12-13H2,1-2H3,(H3-,25,26,27,28,32,33,34) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)C(=O)N | |
| AKOS005253970 | 537.548 | C24 H23 N7 O6 S | HPNVTFGWCNWDRV-UHFFFAOYSA-N | InChI=1S/C24H23N7O6S/c1-3-29-23(34)18(13-20(32)25-16-9-11-17(12-10-16)31(35)36)30(24(29)38)14-19-22(37-27-28(19)2)26-21(33)15-7-5-4-6-8-15/h4-12,18H,3,13-14H2,1-2H3,(H-,25,26,27,32,33) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)N(=O)=O | |
| AKOS005219524 | 448.537 | C24 H24 N4 O3 S | HTEPINBLRFQAMY-UHFFFAOYSA-N | InChI=1S/C24H24N4O3S/c1-24(2,3)17-9-10-19-15(12-17)11-16(13-25)22(26-19)32-14-20(29)21-23(30)31-27-28(21)18-7-5-4-6-8-18/h4-8,11,17H,9-10,12,14H2,1-3H3 | CC(C)(C)C1CCc2c(cc(c(n2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])C#N)C1 | |
| AKOS005253794 | 448.537 | C24 H24 N4 O3 S | XGRJTQZWTTVDKT-UHFFFAOYSA-N | InChI=1S/C24H24N4O3S/c1-24(2,3)14-9-10-17-13(11-14)12-16-18(25)21(32-22(16)26-17)20(29)19-23(30)31-27-28(19)15-7-5-4-6-8-15/h4-8,12,14H,9-11H2,1-3H3,(H2-,25,27,29,30) | CC(C)(C)C1CCc2c(cc3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)C1 | |
| AKOS005250870 | 432.472 | C24 H24 N4 O4 | NQYBGKLNOJGRQI-UHFFFAOYSA-O | InChI=1S/C24H23N4O4/c1-17-12-14-27(15-13-17)23(30)20(25-22(29)18-8-4-2-5-9-18)16-21-24(31)32-26-28(21)19-10-6-3-7-11-19/h2-11,16-17H,12-15H2,1H3/q-1/p+1 | CC1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005250981 | 432.472 | C24 H24 N4 O4 | RVNJQFYHXZIYLI-UHFFFAOYSA-O | InChI=1S/C24H23N4O4/c1-17-10-8-9-15-27(17)23(30)20(25-22(29)18-11-4-2-5-12-18)16-21-24(31)32-26-28(21)19-13-6-3-7-14-19/h2-7,11-14,16-17H,8-10,15H2,1H3/q-1/p+1 | CC1CCCCN1C(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005250982 | 432.472 | C24 H24 N4 O4 | HZJMWUQIYBQFFV-UHFFFAOYSA-O | InChI=1S/C24H23N4O4/c1-17-9-8-14-27(16-17)23(30)20(25-22(29)18-10-4-2-5-11-18)15-21-24(31)32-26-28(21)19-12-6-3-7-13-19/h2-7,10-13,15,17H,8-9,14,16H2,1H3/q-1/p+1 | CC1CCCN(C1)C(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251021 | 432.472 | C24 H24 N4 O4 | YMDDQVUWJWUWEQ-UHFFFAOYSA-O | InChI=1S/C24H23N4O4/c29-22(17-10-4-1-5-11-17)26-20(23(30)25-18-12-6-2-7-13-18)16-21-24(31)32-27-28(21)19-14-8-3-9-15-19/h1,3-5,8-11,14-16,18H,2,6-7,12-13H2,(H,25,30)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NC4CCCCC4 | |
| AKOS005250878 | 448.471 | C24 H24 N4 O5 | HYCWYLFMRUGTMB-UHFFFAOYSA-O | InChI=1S/C24H23N4O5/c1-32-19-12-10-18(11-13-19)28-21(24(31)33-26-28)16-20(23(30)27-14-6-3-7-15-27)25-22(29)17-8-4-2-5-9-17/h2,4-5,8-13,16H,3,6-7,14-15H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCCCC3)\NC(=O)c4ccccc4 | |
| AKOS005250976 | 448.471 | C24 H24 N4 O5 | FDODYLYTDRUOIZ-UHFFFAOYSA-O | InChI=1S/C24H23N4O5/c1-16-14-27(15-17(2)32-16)23(30)20(25-22(29)18-9-5-3-6-10-18)13-21-24(31)33-26-28(21)19-11-7-4-8-12-19/h3-13,16-17H,14-15H2,1-2H3/q-1/p+1 | CC1CN(CC(O1)C)C(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251089 | 448.471 | C24 H24 N4 O5 | YCGUUCRXVWDULC-UHFFFAOYSA-O | InChI=1S/C24H23N4O5/c1-32-19-13-11-18(12-14-19)28-21(24(31)33-27-28)15-20(23(30)25-17-9-5-6-10-17)26-22(29)16-7-3-2-4-8-16/h2-4,7-8,11-15,17H,5-6,9-10H2,1H3,(H,25,30)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NC3CCCC3)\NC(=O)c4ccccc4 | |
| AKOS005251362 | 448.471 | C24 H24 N4 O5 | QKTUPCXEXPIZOQ-UHFFFAOYSA-N | InChI=1S/C24H24N4O5/c1-2-32-19-12-10-17(11-13-19)27-22(29)14-20(23(27)30)26(16-8-9-16)15-21-24(31)33-25-28(21)18-6-4-3-5-7-18/h3-7,10-13,16,20H,2,8-9,14-15H2,1H3 | CCOc1ccc(cc1)N2C(=O)CC(C2=O)N(Cc3c(on[n+]3c4ccccc4)[O-])C5CC5 | |
| AKOS005251365 | 448.471 | C24 H24 N4 O5 | UMNLKDNMVLPFES-UHFFFAOYSA-N | InChI=1S/C24H24N4O5/c1-15-3-5-17(6-4-15)27-22(29)13-20(23(27)30)26(16-7-8-16)14-21-24(31)33-25-28(21)18-9-11-19(32-2)12-10-18/h3-6,9-12,16,20H,7-8,13-14H2,1-2H3 | Cc1ccc(cc1)N2C(=O)CC(C2=O)N(Cc3c(on[n+]3c4ccc(cc4)OC)[O-])C5CC5 | |
| AKOS005253598 | 448.471 | C24 H24 N4 O5 | PUCCYECDWVZWSJ-BQYQJAHWSA-N | InChI=1S/C24H24N4O5/c1-27-20(24(31)33-26-27)16-28-13-14-32-21(23(28)30)15-22(29)25-19-11-9-18(10-12-19)8-7-17-5-3-2-4-6-17/h2-12,21H,13-16H2,1H3,(H-,25,26,29,31)/b8-7+ | C[n+]1c(c(on1)[O-])CN2CCOC(C2=O)CC(=O)Nc3ccc(cc3)/C=C/c4ccccc4 | |
| AKOS005250887 | 464.471 | C24 H24 N4 O6 | NKBHMWLYWWKWRE-UHFFFAOYSA-O | InChI=1S/C24H23N4O6/c1-33-19-9-7-17(8-10-19)28-21(24(32)34-26-28)15-20(23(31)27-13-11-18(29)12-14-27)25-22(30)16-5-3-2-4-6-16/h2-10,15,18,29H,11-14H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCC(CC3)O)\NC(=O)c4ccccc4 | |
| AKOS005251086 | 464.471 | C24 H24 N4 O6 | QEOJDFPAKATJRX-UHFFFAOYSA-O | InChI=1S/C24H23N4O6/c1-32-18-11-9-17(10-12-18)28-21(24(31)34-27-28)14-20(23(30)25-15-19-8-5-13-33-19)26-22(29)16-6-3-2-4-7-16/h2-4,6-7,9-12,14,19H,5,8,13,15H2,1H3,(H,25,30)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCC3CCCO3)\NC(=O)c4ccccc4 | |
| AKOS005251381 | 464.471 | C24 H24 N4 O6 | KBLNVCWYSVBOTI-UHFFFAOYSA-N | InChI=1S/C24H24N4O6/c1-32-18-9-5-16(6-10-18)27-22(29)13-20(23(27)30)26(15-3-4-15)14-21-24(31)34-25-28(21)17-7-11-19(33-2)12-8-17/h5-12,15,20H,3-4,13-14H2,1-2H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C4CC(=O)N(C4=O)c5ccc(cc5)OC | |
| AKOS005251317 | 480.47 | C24 H24 N4 O7 | LMYQTNWGTZGEPO-UHFFFAOYSA-N | InChI=1S/C24H24N4O7/c1-4-34-23(31)15-5-7-16(8-6-15)27-21(29)13-19(22(27)30)26(2)14-20-24(32)35-25-28(20)17-9-11-18(33-3)12-10-17/h5-12,19H,4,13-14H2,1-3H3 | CCOC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)N(C)Cc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005253618 | 480.47 | C24 H24 N4 O7 | WKZIOTCVPVHXET-UHFFFAOYSA-N | InChI=1S/C24H24N4O7/c1-15(29)16-3-5-17(6-4-16)25-22(30)13-21-23(31)27(11-12-34-21)14-20-24(32)35-26-28(20)18-7-9-19(33-2)10-8-18/h3-10,21H,11-14H2,1-2H3,(H-,25,26,29,30,32) | CC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005253619 | 480.47 | C24 H24 N4 O7 | FOPDFCBEGWSCQF-UHFFFAOYSA-N | InChI=1S/C24H24N4O7/c1-2-33-23(31)16-8-10-17(11-9-16)25-21(29)14-20-22(30)27(12-13-34-20)15-19-24(32)35-26-28(19)18-6-4-3-5-7-18/h3-11,20H,2,12-15H2,1H3,(H-,25,26,29,31,32) | CCOC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005253625 | 496.469 | C24 H24 N4 O8 | KEIIFDDQIKDCMN-UHFFFAOYSA-N | InChI=1S/C24H24N4O8/c1-33-18-9-7-17(8-10-18)28-19(24(32)36-26-28)14-27-11-12-35-20(22(27)30)13-21(29)25-16-5-3-15(4-6-16)23(31)34-2/h3-10,20H,11-14H2,1-2H3,(H-,25,26,29,31,32) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)C(=O)OC | |
| AKOS005253052 | 460.551 | C24 H24 N6 O2 S | BDAMYLPIHFWSEN-UHFFFAOYSA-N | InChI=1S/C24H24N6O2S/c31-20(25-21-16-30(28-32-21)29-14-8-3-9-15-29)17-33-24-26-22(18-10-4-1-5-11-18)23(27-24)19-12-6-2-7-13-19/h1-2,4-7,10-13,16H,3,8-9,14-15,17H2,(H-,25,26,27,28,31) | c1ccc(cc1)c2c(nc([nH]2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005252928 | 476.551 | C24 H24 N6 O3 S | PLPCRCJAUSLJCG-XSFVSMFZSA-N | InChI=1S/C24H24N6O3S/c1-4-29-15-22(33-27-29)26-21(31)16-34-24-25-20(14-17-10-12-18(13-11-17)28(2)3)23(32)30(24)19-8-6-5-7-9-19/h5-15H,4,16H2,1-3H3/b20-14+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)N(C)C)/C(=O)N2c4ccccc4 | |
| AKOS005253037 | 476.551 | C24 H24 N6 O3 S | IEORJAZCRAHIBZ-UHFFFAOYSA-N | InChI=1S/C24H24N6O3S/c25-14-20-13-19-12-18(17-4-2-1-3-5-17)6-7-21(19)26-24(20)34-16-22(31)27-23-15-30(28-33-23)29-8-10-32-11-9-29/h1-5,13,15,18H,6-12,16H2 | c1ccc(cc1)C2CCc3c(cc(c(n3)SCC(=O)[N-]c4c[n+](no4)N5CCOCC5)C#N)C2 | |
| AKOS005252757 | 492.55 | C24 H24 N6 O4 S | PQDUARBWVNOCIR-XMHGGMMESA-N | InChI=1S/C24H24N6O4S/c1-4-33-20-13-9-8-10-17(20)14-19-23(32)30(18-11-6-5-7-12-18)24(25-19)35-16-21(31)26-22-15-29(27-34-22)28(2)3/h5-15H,4,16H2,1-3H3/b19-14+ | CCOc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N(C)C)c4ccccc4 | |
| AKOS005252763 | 492.55 | C24 H24 N6 O4 S | MEUILSRYRDNDRM-XSFVSMFZSA-N | InChI=1S/C24H24N6O4S/c1-4-33-19-12-10-17(11-13-19)14-20-23(32)30(18-8-6-5-7-9-18)24(25-20)35-16-21(31)26-22-15-29(27-34-22)28(2)3/h5-15H,4,16H2,1-3H3/b20-14+ | CCOc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N(C)C)c4ccccc4 | |
| AKOS005253934 | 492.55 | C24 H24 N6 O4 S | AXJLSZCRCMVLMR-UHFFFAOYSA-N | InChI=1S/C24H24N6O4S/c1-15-9-11-17(12-10-15)25-20(31)13-18-23(33)28(2)24(35)30(18)14-19-22(34-27-29(19)3)26-21(32)16-7-5-4-6-8-16/h4-12,18H,13-14H2,1-3H3,(H-,25,26,27,31,32) | Cc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)C | |
| AKOS005253960 | 492.55 | C24 H24 N6 O4 S | WBVUJHALTBUFQS-UHFFFAOYSA-N | InChI=1S/C24H24N6O4S/c1-3-29-23(33)18(14-20(31)25-17-12-8-5-9-13-17)30(24(29)35)15-19-22(34-27-28(19)2)26-21(32)16-10-6-4-7-11-16/h4-13,18H,3,14-15H2,1-2H3,(H-,25,26,27,31,32) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccccc4 | |
| AKOS005252726 | 508.55 | C24 H24 N6 O5 S | QIROIXUHOBTYNA-QGOAFFKASA-N | InChI=1S/C24H24N6O5S/c1-28(2)29-14-21(35-27-29)26-20(31)15-36-24-25-18(23(32)30(24)17-10-6-5-7-11-17)13-16-9-8-12-19(33-3)22(16)34-4/h5-14H,15H2,1-4H3/b18-13+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252732 | 508.55 | C24 H24 N6 O5 S | CJKXUIAUVAHUDR-XDHOZWIPSA-N | InChI=1S/C24H24N6O5S/c1-28(2)29-14-22(35-27-29)26-21(31)15-36-24-25-19(23(32)30(24)17-8-6-5-7-9-17)12-16-10-11-18(33-3)13-20(16)34-4/h5-14H,15H2,1-4H3/b19-12+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252733 | 508.55 | C24 H24 N6 O5 S | PYYQGPSBUVYNIS-CPNJWEJPSA-N | InChI=1S/C24H24N6O5S/c1-28(2)29-14-22(35-27-29)26-21(31)15-36-24-25-19(23(32)30(24)17-8-6-5-7-9-17)13-16-12-18(33-3)10-11-20(16)34-4/h5-14H,15H2,1-4H3/b19-13+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cc(ccc3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252740 | 508.55 | C24 H24 N6 O5 S | MKEYFZPSOCNHSA-LDADJPATSA-N | InChI=1S/C24H24N6O5S/c1-28(2)29-14-22(35-27-29)26-21(31)15-36-24-25-18(23(32)30(24)17-8-6-5-7-9-17)12-16-10-11-19(33-3)20(13-16)34-4/h5-14H,15H2,1-4H3/b18-12+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(c(c3)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253830 | 508.55 | C24 H24 N6 O5 S | QRKPNDKXDZMTLX-UHFFFAOYSA-N | InChI=1S/C24H24N6O5S/c1-14-4-10-18(11-5-14)30-22(33)19(29(24(30)36)13-20-23(34)35-27-28(20)3)12-21(32)26-17-8-6-16(7-9-17)25-15(2)31/h4-11,19,27,34H,12-13H2,1-3H3 | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)NC(=O)C | |
| AKOS005254035 | 508.55 | C24 H24 N6 O5 S | GEVLZRWVIKYFBW-UHFFFAOYSA-N | InChI=1S/C24H24N6O5S/c1-28-23(33)18(13-20(31)25-16-9-11-17(34-3)12-10-16)30(24(28)36)14-19-22(35-27-29(19)2)26-21(32)15-7-5-4-6-8-15/h4-12,18H,13-14H2,1-3H3,(H-,25,26,27,31,32) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)OC | |
| AKOS005253922 | 524.549 | C24 H24 N6 O6 S | CVVOQKMSFHTQNL-UHFFFAOYSA-N | InChI=1S/C24H24N6O6S/c1-3-35-17-10-8-16(9-11-17)30-22(33)18(29(24(30)37)13-19-23(34)36-27-28(19)2)12-20(31)26-15-6-4-14(5-7-15)21(25)32/h4-11,18H,3,12-13H2,1-2H3,(H3-,25,26,27,31,32,34) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)C(=O)N | |
| AKOS005253070 | 488.565 | C24 H24 N8 O2 S | GRCKJMRFXMLZIR-UHFFFAOYSA-N | InChI=1S/C24H24N8O2S/c1-2-16-6-8-17(9-7-16)22-18(12-25)23(27)29-24(19(22)13-26)35-15-20(33)28-21-14-32(30-34-21)31-10-4-3-5-11-31/h6-9,14H,2-5,10-11,15H2,1H3,(H2-,27,28,29,30,33) | CCc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)N)C#N | |
| AKOS005253017 | 504.564 | C24 H24 N8 O3 S | FGPLZSSPSLROHA-UHFFFAOYSA-N | InChI=1S/C24H24N8O3S/c1-15(2)16-3-5-17(6-4-16)22-18(11-25)23(27)29-24(19(22)12-26)36-14-20(33)28-21-13-32(30-35-21)31-7-9-34-10-8-31/h3-6,13,15H,7-10,14H2,1-2H3,(H2-,27,28,29,30,33) | CC(C)c1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)N)C#N | |
| AKOS005253004 | 552.562 | C24 H24 N8 O6 S | ZUMOBZKHIXOWME-UHFFFAOYSA-N | InChI=1S/C24H24N8O6S/c1-34-17-8-14(9-18(35-2)22(17)36-3)21-15(10-25)23(27)29-24(16(21)11-26)39-13-19(33)28-20-12-32(30-38-20)31-4-6-37-7-5-31/h8-9,12H,4-7,13H2,1-3H3,(H2-,27,28,29,30,33) | COc1cc(cc(c1OC)OC)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)N)C#N | |
| AKOS005254171 | 621.526 | C24 H25 Br N6 O5 S2 | WJJNCOUJMSANRZ-UHFFFAOYSA-N | InChI=1S/C24H25BrN6O5S2/c1-4-30-23(33)19(13-21(32)26-17-9-7-16(25)8-10-17)31(24(30)37)14-20-22(36-28-29(20)3)27-38(34,35)18-11-5-15(2)6-12-18/h5-12,19H,4,13-14H2,1-3H3,(H-,26,27,28,32) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)Br | |
| AKOS005254161 | 577.076 | C24 H25 Cl N6 O5 S2 | FVLYQTBTZCTQEW-UHFFFAOYSA-N | InChI=1S/C24H25ClN6O5S2/c1-4-30-23(33)19(13-21(32)26-17-9-7-16(25)8-10-17)31(24(30)37)14-20-22(36-28-29(20)3)27-38(34,35)18-11-5-15(2)6-12-18/h5-12,19H,4,13-14H2,1-3H3,(H-,26,27,28,32) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)Cl | |
| AKOS005254107 | 560.621 | C24 H25 F N6 O5 S2 | MKLIUHITXJDBGD-UHFFFAOYSA-N | InChI=1S/C24H25FN6O5S2/c1-4-30-23(33)19(13-21(32)26-17-9-7-16(25)8-10-17)31(24(30)37)14-20-22(36-28-29(20)3)27-38(34,35)18-11-5-15(2)6-12-18/h5-12,19H,4,13-14H2,1-3H3,(H-,26,27,28,32) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)F | |
| AKOS005254176 | 668.527 | C24 H25 I N6 O5 S2 | LFULQUWJWWNLPI-UHFFFAOYSA-N | InChI=1S/C24H25IN6O5S2/c1-4-30-23(33)19(13-21(32)26-17-9-7-16(25)8-10-17)31(24(30)37)14-20-22(36-28-29(20)3)27-38(34,35)18-11-5-15(2)6-12-18/h5-12,19H,4,13-14H2,1-3H3,(H-,26,27,28,32) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)I | |
| AKOS005250892 | 447.486 | C24 H25 N5 O4 | RVVKSESMHSGWFH-UHFFFAOYSA-O | InChI=1S/C24H24N5O4/c1-17-8-10-19(11-9-17)28-12-14-29(15-13-28)23(31)20(16-21-24(32)33-26-27(21)2)25-22(30)18-6-4-3-5-7-18/h3-11,16H,12-15H2,1-2H3/q-1/p+1 | Cc1ccc(cc1)N2CCN(CC2)C(=O)/C(=C/c3c(on[n+]3C)[O-])/NC(=O)c4ccccc4 | |
| AKOS005250908 | 447.486 | C24 H25 N5 O4 | KJMJZDGCSIUJEP-UHFFFAOYSA-O | InChI=1S/C24H24N5O4/c1-27-21(24(32)33-26-27)16-20(25-22(30)19-10-6-3-7-11-19)23(31)29-14-12-28(13-15-29)17-18-8-4-2-5-9-18/h2-11,16H,12-15,17H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCN(CC2)Cc3ccccc3)\NC(=O)c4ccccc4 | |
| AKOS005250977 | 447.486 | C24 H25 N5 O4 | MERVUEMYZZHPEX-UHFFFAOYSA-O | InChI=1S/C24H24N5O4/c1-27-13-8-14-28(16-15-27)23(31)20(25-22(30)18-9-4-2-5-10-18)17-21-24(32)33-26-29(21)19-11-6-3-7-12-19/h2-7,9-12,17H,8,13-16H2,1H3/q-1/p+1 | CN1CCCN(CC1)C(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251041 | 447.486 | C24 H25 N5 O4 | HHJJRKULOYRNJZ-UHFFFAOYSA-O | InChI=1S/C24H24N5O4/c1-2-27-13-15-28(16-14-27)23(31)20(25-22(30)18-9-5-3-6-10-18)17-21-24(32)33-26-29(21)19-11-7-4-8-12-19/h3-12,17H,2,13-16H2,1H3/q-1/p+1 | CCN1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005250978 | 463.486 | C24 H25 N5 O5 | IMYGSQZJMXJUQT-UHFFFAOYSA-O | InChI=1S/C24H24N5O5/c1-27-12-14-28(15-13-27)23(31)20(25-22(30)17-6-4-3-5-7-17)16-21-24(32)34-26-29(21)18-8-10-19(33-2)11-9-18/h3-11,16H,12-15H2,1-2H3/q-1/p+1 | CN1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2c3ccc(cc3)OC)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251008 | 463.486 | C24 H25 N5 O5 | KLXUALZDXJYQPS-UHFFFAOYSA-O | InChI=1S/C24H24N5O5/c1-33-19-12-10-18(11-13-19)29-21(24(32)34-27-29)16-20(23(31)26-28-14-6-3-7-15-28)25-22(30)17-8-4-2-5-9-17/h2,4-5,8-13,16H,3,6-7,14-15H2,1H3,(H,26,31)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NN3CCCCC3)\NC(=O)c4ccccc4 | |
| AKOS005251039 | 463.486 | C24 H25 N5 O5 | APCOKQZHZBUTSL-UHFFFAOYSA-O | InChI=1S/C24H24N5O5/c30-22(18-7-3-1-4-8-18)26-20(23(31)25-11-12-28-13-15-33-16-14-28)17-21-24(32)34-27-29(21)19-9-5-2-6-10-19/h1-10,17H,11-16H2,(H,25,31)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCCN4CCOCC4 | |
| AKOS005251077 | 463.486 | C24 H25 N5 O5 | RAERHBXGIJRENQ-UHFFFAOYSA-O | InChI=1S/C24H24N5O5/c30-16-15-27-11-13-28(14-12-27)23(32)20(25-22(31)18-7-3-1-4-8-18)17-21-24(33)34-26-29(21)19-9-5-2-6-10-19/h1-10,17,30H,11-16H2/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CCN(CC4)CCO | |
| AKOS005253824 | 495.551 | C24 H25 N5 O5 S | GQVYAKGFLNGNMD-UHFFFAOYSA-N | InChI=1S/C24H25N5O5S/c1-4-33-18-11-7-16(8-12-18)25-21(30)13-19-22(31)29(17-9-5-15(2)6-10-17)24(35)28(19)14-20-23(32)34-26-27(20)3/h5-12,19H,4,13-14H2,1-3H3,(H-,25,26,30,32) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])c4ccc(cc4)C | |
| AKOS005253921 | 495.551 | C24 H25 N5 O5 S | ASLMOWPNTKBQPA-UHFFFAOYSA-N | InChI=1S/C24H25N5O5S/c1-4-33-18-11-9-17(10-12-18)29-22(31)19(13-21(30)25-16-7-5-15(2)6-8-16)28(24(29)35)14-20-23(32)34-26-27(20)3/h5-12,19H,4,13-14H2,1-3H3,(H-,25,26,30,32) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)C | |
| AKOS005251671 | 527.616 | C24 H25 N5 O5 S2 | YJKAIAWJWJJWLK-UHFFFAOYSA-N | InChI=1S/C24H25N5O5S2/c1-14(35-21-22(31)34-27-29(21)15-8-6-5-7-9-15)19(30)26-20-17(12-25)16-10-11-28(13-18(16)36-20)23(32)33-24(2,3)4/h5-9,14H,10-11,13H2,1-4H3,(H-,26,27,30,31) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)OC(C)(C)C)C#N)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252570 | 527.616 | C24 H25 N5 O5 S2 | DMWTZTGGBDPRRN-UHFFFAOYSA-N | InChI=1S/C24H25N5O5S2/c1-24(2,3)33-23(32)28-11-9-16-17(13-25)20(36-18(16)14-28)26-19(30)10-12-35-21-22(31)34-27-29(21)15-7-5-4-6-8-15/h4-8H,9-12,14H2,1-3H3,(H-,26,27,30,31) | CC(C)(C)OC(=O)N1CCc2c(sc(c2C#N)NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005253929 | 511.55 | C24 H25 N5 O6 S | LRUQVPHUTLAJHE-UHFFFAOYSA-N | InChI=1S/C24H25N5O6S/c1-4-34-18-11-7-16(8-12-18)29-22(31)19(13-21(30)25-15-5-9-17(33-3)10-6-15)28(24(29)36)14-20-23(32)35-26-27(20)2/h5-12,19H,4,13-14H2,1-3H3,(H-,25,26,30,32) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)OC | |
| AKOS005251387 | 543.615 | C24 H25 N5 O6 S2 | SYQRNELMHKLMRX-UHFFFAOYSA-N | InChI=1S/C24H25N5O6S2/c1-24(2,3)34-23(32)28-10-9-16-17(11-25)20(37-18(16)12-28)26-19(30)13-36-21-22(31)35-27-29(21)14-5-7-15(33-4)8-6-14/h5-8H,9-10,12-13H2,1-4H3,(H-,26,27,30,31) | CC(C)(C)OC(=O)N1CCc2c(sc(c2C#N)NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005253632 | 495.485 | C24 H25 N5 O7 | QLTYBVQGAMTXDC-UHFFFAOYSA-N | InChI=1S/C24H25N5O7/c1-15(30)25-16-3-5-17(6-4-16)26-22(31)13-21-23(32)28(11-12-35-21)14-20-24(33)36-27-29(20)18-7-9-19(34-2)10-8-18/h3-10,21,27,33H,11-14H2,1-2H3 | CC(=O)Nc1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252741 | 491.565 | C24 H25 N7 O3 S | ALZPCIBPVCPOSY-XSFVSMFZSA-N | InChI=1S/C24H25N7O3S/c1-28(2)18-12-10-17(11-13-18)14-20-23(33)31(19-8-6-5-7-9-19)24(25-20)35-16-21(32)26-22-15-30(27-34-22)29(3)4/h5-15H,16H2,1-4H3/b20-14+ | CN(C)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N(C)C)c4ccccc4 | |
| AKOS005253964 | 571.629 | C24 H25 N7 O6 S2 | ZYVWNGGBHGTVID-UHFFFAOYSA-N | InChI=1S/C24H25N7O6S2/c1-3-30-23(34)18(13-20(32)26-16-9-11-17(12-10-16)39(25,35)36)31(24(30)38)14-19-22(37-28-29(19)2)27-21(33)15-7-5-4-6-8-15/h4-12,18H,3,13-14H2,1-2H3,(H3-,25,26,27,28,32,33,35,36) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)S(=O)(=O)N | |
| AKOS005254135 | 571.629 | C24 H25 N7 O6 S2 | WNFZQAFGKQMCCF-UHFFFAOYSA-N | InChI=1S/C24H25N7O6S2/c1-14-4-10-17(11-5-14)39(35,36)27-22-19(30(3)28-37-22)13-31-18(23(34)29(2)24(31)38)12-20(32)26-16-8-6-15(7-9-16)21(25)33/h4-11,18H,12-13H2,1-3H3,(H3-,25,26,27,28,32,33) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)C(=O)N | |
| AKOS005254119 | 587.628 | C24 H25 N7 O7 S2 | JOBNJTUNPOLDFI-UHFFFAOYSA-N | InChI=1S/C24H25N7O7S2/c1-4-29-23(33)19(13-21(32)25-16-7-9-17(10-8-16)31(34)35)30(24(29)39)14-20-22(38-27-28(20)3)26-40(36,37)18-11-5-15(2)6-12-18/h5-12,19H,4,13-14H2,1-3H3,(H-,25,26,27,32) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)N(=O)=O | |
| AKOS005251763 | 482.618 | C24 H26 N4 O3 S2 | DKULZRSRNXKGOC-UHFFFAOYSA-N | InChI=1S/C24H26N4O3S2/c1-14(32-22-23(30)31-27-28(22)16-8-6-5-7-9-16)20(29)26-21-18(13-25)17-11-10-15(24(2,3)4)12-19(17)33-21/h5-9,14-15H,10-12H2,1-4H3,(H-,26,27,29,30) | CC(C(=O)Nc1c(c2c(s1)CC(CC2)C(C)(C)C)C#N)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252547 | 482.618 | C24 H26 N4 O3 S2 | WYFNQFDLUSWTFA-UHFFFAOYSA-N | InChI=1S/C24H26N4O3S2/c1-24(2,3)15-9-10-17-18(14-25)21(33-19(17)13-15)26-20(29)11-12-32-22-23(30)31-27-28(22)16-7-5-4-6-8-16/h4-8,15H,9-13H2,1-3H3,(H-,26,27,29,30) | CC(C)(C)C1CCc2c(sc(c2C#N)NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005251516 | 498.618 | C24 H26 N4 O4 S2 | MWDKEPUSQKLBNF-UHFFFAOYSA-N | InChI=1S/C24H26N4O4S2/c1-24(2,3)14-5-10-17-18(12-25)21(34-19(17)11-14)26-20(29)13-33-22-23(30)32-27-28(22)15-6-8-16(31-4)9-7-15/h6-9,14H,5,10-11,13H2,1-4H3,(H-,26,27,29,30) | CC(C)(C)C1CCc2c(sc(c2C#N)NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005250994 | 450.487 | C24 H26 N4 O5 | MTVNAOXHFBMRRR-UHFFFAOYSA-O | InChI=1S/C24H25N4O5/c1-5-24(2,3)26-22(30)19(25-21(29)16-9-7-6-8-10-16)15-20-23(31)33-27-28(20)17-11-13-18(32-4)14-12-17/h6-15H,5H2,1-4H3,(H,26,30)/q-1/p+1 | CCC(C)(C)NC(=O)/C(=C/c1c(on[n+]1c2ccc(cc2)OC)[O-])/NC(=O)c3ccccc3 | |
| AKOS005251091 | 466.486 | C24 H26 N4 O6 | SEFGURQFGLLMDF-UHFFFAOYSA-O | InChI=1S/C24H25N4O6/c1-3-33-15-7-14-25-23(30)20(26-22(29)17-8-5-4-6-9-17)16-21-24(31)34-27-28(21)18-10-12-19(32-2)13-11-18/h4-6,8-13,16H,3,7,14-15H2,1-2H3,(H,25,30)/q-1/p+1 | CCOCCCNC(=O)/C(=C/c1c(on[n+]1c2ccc(cc2)OC)[O-])/NC(=O)c3ccccc3 | |
| AKOS005251933 | 530.616 | C24 H26 N4 O6 S2 | AYDHQTNLRNZAJV-UHFFFAOYSA-N | InChI=1S/C24H26N4O6S2/c1-4-17(36-22-24(32)34-26-28(22)15-9-7-6-8-10-15)20(30)25-21-19(23(31)33-5-2)16-11-12-27(14(3)29)13-18(16)35-21/h6-10,17H,4-5,11-13H2,1-3H3,(H-,25,26,30,31,32) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)C)C(=O)OCC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005219857 | 482.486 | C24 H26 N4 O7 | IZCXGCFRHBOIMT-UHFFFAOYSA-N | InChI=1S/C24H26N4O7/c1-33-19-10-8-17(9-11-19)28-21(24(32)35-25-28)13-27(16-6-7-16)22(29)14-26(15-23(30)31)18-4-3-5-20(12-18)34-2/h3-5,8-12,16H,6-7,13-15H2,1-2H3,(H-,25,30,31,32) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)CN(CC(=O)O)c4cccc(c4)OC | |
| AKOS005250090 | 482.486 | C24 H26 N4 O7 | QTLNIBXTRLBWNZ-UHFFFAOYSA-N | InChI=1S/C24H26N4O7/c1-33-19-9-5-16(6-10-19)26(15-23(30)31)14-22(29)27(17-3-4-17)13-21-24(32)35-25-28(21)18-7-11-20(34-2)12-8-18/h5-12,17H,3-4,13-15H2,1-2H3,(H-,25,30,31,32) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C(=O)CN(CC(=O)O)c4ccc(cc4)OC | |
| AKOS005253609 | 482.486 | C24 H26 N4 O7 | NSTDOCYGFXTUSO-UHFFFAOYSA-N | InChI=1S/C24H26N4O7/c1-3-33-19-8-4-16(5-9-19)25-22(29)14-21-23(30)27(12-13-34-21)15-20-24(31)35-26-28(20)17-6-10-18(32-2)11-7-17/h4-11,21H,3,12-15H2,1-2H3,(H-,25,26,29,31) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005251589 | 546.616 | C24 H26 N4 O7 S2 | GHOWWCOZPSQAGB-UHFFFAOYSA-N | InChI=1S/C24H26N4O7S2/c1-24(2,3)34-23(32)27-11-10-15-16(12-27)37-19(18(15)21(30)33-4)25-17(29)13-36-20-22(31)35-26-28(20)14-8-6-5-7-9-14/h5-9H,10-13H2,1-4H3,(H-,25,26,29,30,31) | CC(C)(C)OC(=O)N1CCc2c(sc(c2C(=O)OC)NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005251721 | 546.616 | C24 H26 N4 O7 S2 | FXEZQHPTEAGESR-UHFFFAOYSA-N | InChI=1S/C24H26N4O7S2/c1-5-34-23(31)19-17-10-11-27(14(3)29)12-18(17)37-21(19)25-20(30)13(2)36-22-24(32)35-26-28(22)15-6-8-16(33-4)9-7-15/h6-9,13H,5,10-12H2,1-4H3,(H-,25,26,30,31,32) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccc(cc4)OC)[O-])CN(CC2)C(=O)C | |
| AKOS005252277 | 546.616 | C24 H26 N4 O7 S2 | IGRRJLQDCJWYBI-UHFFFAOYSA-N | InChI=1S/C24H26N4O7S2/c1-5-17(37-22-24(32)35-26-28(22)14-6-8-15(33-3)9-7-14)20(30)25-21-19(23(31)34-4)16-10-11-27(13(2)29)12-18(16)36-21/h6-9,17H,5,10-12H2,1-4H3,(H-,25,26,30,31,32) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)C)C(=O)OC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252581 | 546.616 | C24 H26 N4 O7 S2 | IMMMNFAILWSXAZ-UHFFFAOYSA-N | InChI=1S/C24H26N4O7S2/c1-4-34-23(31)20-17-9-11-27(14(2)29)13-18(17)37-21(20)25-19(30)10-12-36-22-24(32)35-26-28(22)15-5-7-16(33-3)8-6-15/h5-8H,4,9-13H2,1-3H3,(H-,25,26,30,31,32) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])CN(CC2)C(=O)C | |
| AKOS005250196 | 530.55 | C24 H26 N4 O8 S | UZTDFBCHWIPMMC-UHFFFAOYSA-N | InChI=1S/C24H26N4O8S/c1-24(2,3)35-23(32)27-11-10-15-16(12-27)37-20(17(15)21(30)34-5)25-19(29)18-22(31)36-26-28(18)13-6-8-14(33-4)9-7-13/h6-9H,10-12H2,1-5H3,(H-,25,26,29,30,31) | CC(C)(C)OC(=O)N1CCc2c(sc(c2C(=O)OC)NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005254109 | 542.63 | C24 H26 N6 O5 S2 | YMQCDZBUIJMVHC-UHFFFAOYSA-N | InChI=1S/C24H26N6O5S2/c1-15-5-9-17(10-6-15)25-21(31)13-19-23(32)28(3)24(36)30(19)14-20-22(35-27-29(20)4)26-37(33,34)18-11-7-16(2)8-12-18/h5-12,19H,13-14H2,1-4H3,(H-,25,26,27,31) | Cc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)C | |
| AKOS005254160 | 542.63 | C24 H26 N6 O5 S2 | QWIFNMBQZLSTAX-UHFFFAOYSA-N | InChI=1S/C24H26N6O5S2/c1-4-29-23(32)19(14-21(31)25-17-8-6-5-7-9-17)30(24(29)36)15-20-22(35-27-28(20)3)26-37(33,34)18-12-10-16(2)11-13-18/h5-13,19H,4,14-15H2,1-3H3,(H-,25,26,27,31) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccccc4 | |
| AKOS005254114 | 558.63 | C24 H26 N6 O6 S2 | GSCOITYBUCRBPF-UHFFFAOYSA-N | InChI=1S/C24H26N6O6S2/c1-15-5-11-18(12-6-15)38(33,34)26-22-20(29(3)27-36-22)14-30-19(23(32)28(2)24(30)37)13-21(31)25-16-7-9-17(35-4)10-8-16/h5-12,19H,13-14H2,1-4H3,(H-,25,26,27,31) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)OC | |
| AKOS005251604 | 501.618 | C24 H27 N3 O5 S2 | WWCFECSZQQQFIU-UHFFFAOYSA-N | InChI=1S/C24H27N3O5S2/c1-24(2,3)14-10-11-16-17(12-14)34-20(19(16)22(29)31-4)25-18(28)13-33-21-23(30)32-26-27(21)15-8-6-5-7-9-15/h5-9,14H,10-13H2,1-4H3,(H-,25,26,28,29,30) | CC(C)(C)C1CCc2c(sc(c2C(=O)OC)NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005251756 | 501.618 | C24 H27 N3 O5 S2 | OHYFPBQTQSNVAK-UHFFFAOYSA-N | InChI=1S/C24H27N3O5S2/c1-3-31-23(29)19-17-13-9-4-5-10-14-18(17)34-21(19)25-20(28)15(2)33-22-24(30)32-26-27(22)16-11-7-6-8-12-16/h6-8,11-12,15H,3-5,9-10,13-14H2,1-2H3,(H-,25,26,28,29,30) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccccc4)[O-])CCCCCC2 | |
| AKOS005251917 | 501.618 | C24 H27 N3 O5 S2 | ABVVKXREVQPAKW-UHFFFAOYSA-N | InChI=1S/C24H27N3O5S2/c1-3-17(34-22-24(30)32-26-27(22)15-11-7-5-8-12-15)20(28)25-21-19(23(29)31-4-2)16-13-9-6-10-14-18(16)33-21/h5,7-8,11-12,17H,3-4,6,9-10,13-14H2,1-2H3,(H-,25,26,28,29,30) | CCC(C(=O)Nc1c(c2c(s1)CCCCC2)C(=O)OCC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251924 | 501.618 | C24 H27 N3 O5 S2 | LOXKFQMJVQMMDC-UHFFFAOYSA-N | InChI=1S/C24H27N3O5S2/c1-4-17(34-22-24(30)32-26-27(22)15-9-7-6-8-10-15)20(28)25-21-19(23(29)31-5-2)16-12-11-14(3)13-18(16)33-21/h6-10,14,17H,4-5,11-13H2,1-3H3,(H-,25,26,28,29,30) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C)C(=O)OCC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251940 | 501.618 | C24 H27 N3 O5 S2 | TWNHZMBOZDVECD-UHFFFAOYSA-N | InChI=1S/C24H27N3O5S2/c1-3-17(34-22-24(30)32-26-27(22)15-11-7-6-8-12-15)20(28)25-21-19(23(29)31-2)16-13-9-4-5-10-14-18(16)33-21/h6-8,11-12,17H,3-5,9-10,13-14H2,1-2H3,(H-,25,26,28,29,30) | CCC(C(=O)Nc1c(c2c(s1)CCCCCC2)C(=O)OC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251975 | 501.618 | C24 H27 N3 O5 S2 | FNBPSFLDSTXYON-UHFFFAOYSA-N | InChI=1S/C24H27N3O5S2/c1-4-17(34-22-24(30)32-26-27(22)3)20(28)25-21-19(23(29)31-5-2)16-12-11-15(13-18(16)33-21)14-9-7-6-8-10-14/h6-10,15,17H,4-5,11-13H2,1-3H3,(H-,25,26,28,29,30) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)c3ccccc3)C(=O)OCC)Sc4c(on[n+]4C)[O-] | |
| AKOS005252552 | 501.618 | C24 H27 N3 O5 S2 | QGXQYVRTEHIVCJ-UHFFFAOYSA-N | InChI=1S/C24H27N3O5S2/c1-2-31-23(29)20-17-12-8-3-4-9-13-18(17)34-21(20)25-19(28)14-15-33-22-24(30)32-26-27(22)16-10-6-5-7-11-16/h5-7,10-11H,2-4,8-9,12-15H2,1H3,(H-,25,26,28,29,30) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])CCCCCC2 | |
| AKOS005250155 | 485.553 | C24 H27 N3 O6 S | BIVGEFIBHZFGIB-UHFFFAOYSA-N | InChI=1S/C24H27N3O6S/c1-24(2,3)13-6-11-16-17(12-13)34-21(18(16)22(29)32-5)25-20(28)19-23(30)33-26-27(19)14-7-9-15(31-4)10-8-14/h7-10,13H,6,11-12H2,1-5H3,(H-,25,26,28,29,30) | CC(C)(C)C1CCc2c(sc(c2C(=O)OC)NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005251918 | 485.553 | C24 H27 N3 O6 S | CRTCRMGVIBRXSY-UHFFFAOYSA-N | InChI=1S/C24H27N3O6S/c1-4-6-15-32-23(29)16-7-9-17(10-8-16)25-21(28)20(5-2)34-22-24(30)33-26-27(22)18-11-13-19(31-3)14-12-18/h7-14,20H,4-6,15H2,1-3H3,(H-,25,26,28,29,30) | CCCCOC(=O)c1ccc(cc1)NC(=O)C(CC)Sc2c(on[n+]2c3ccc(cc3)OC)[O-] | |
| AKOS005251510 | 517.618 | C24 H27 N3 O6 S2 | KCBSEJIWUUSDKB-UHFFFAOYSA-N | InChI=1S/C24H27N3O6S2/c1-3-32-23(29)20-17-8-6-4-5-7-9-18(17)35-21(20)25-19(28)14-34-22-24(30)33-26-27(22)15-10-12-16(31-2)13-11-15/h10-13H,3-9,14H2,1-2H3,(H-,25,26,28,29,30) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])CCCCCC2 | |
| AKOS005251712 | 517.618 | C24 H27 N3 O6 S2 | ZFDLHGMQRVRFLE-UHFFFAOYSA-N | InChI=1S/C24H27N3O6S2/c1-4-32-23(29)19-17-8-6-5-7-9-18(17)35-21(19)25-20(28)14(2)34-22-24(30)33-26-27(22)15-10-12-16(31-3)13-11-15/h10-14H,4-9H2,1-3H3,(H-,25,26,28,29,30) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccc(cc4)OC)[O-])CCCCC2 | |
| AKOS005251713 | 517.618 | C24 H27 N3 O6 S2 | XIVSBZCFUIOKRG-UHFFFAOYSA-N | InChI=1S/C24H27N3O6S2/c1-14(34-22-24(30)33-26-27(22)15-10-12-16(31-2)13-11-15)20(28)25-21-19(23(29)32-3)17-8-6-4-5-7-9-18(17)35-21/h10-14H,4-9H2,1-3H3,(H-,25,26,28,29,30) | CC(C(=O)Nc1c(c2c(s1)CCCCCC2)C(=O)OC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005251740 | 517.618 | C24 H27 N3 O6 S2 | CVRBAFGNLXJTER-UHFFFAOYSA-N | InChI=1S/C24H27N3O6S2/c1-5-32-23(29)19-17-11-6-13(2)12-18(17)35-21(19)25-20(28)14(3)34-22-24(30)33-26-27(22)15-7-9-16(31-4)10-8-15/h7-10,13-14H,5-6,11-12H2,1-4H3,(H-,25,26,28,29,30) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccc(cc4)OC)[O-])CC(CC2)C | |
| AKOS005252268 | 517.618 | C24 H27 N3 O6 S2 | WLYVBBXDYMLLAS-UHFFFAOYSA-N | InChI=1S/C24H27N3O6S2/c1-4-17(35-22-24(30)33-26-27(22)14-10-12-15(31-2)13-11-14)20(28)25-21-19(23(29)32-3)16-8-6-5-7-9-18(16)34-21/h10-13,17H,4-9H2,1-3H3,(H-,25,26,28,29,30) | CCC(C(=O)Nc1c(c2c(s1)CCCCC2)C(=O)OC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252270 | 517.618 | C24 H27 N3 O6 S2 | RIYDNFWTQAWXBX-UHFFFAOYSA-N | InChI=1S/C24H27N3O6S2/c1-5-17(35-22-24(30)33-26-27(22)14-7-9-15(31-3)10-8-14)20(28)25-21-19(23(29)32-4)16-11-6-13(2)12-18(16)34-21/h7-10,13,17H,5-6,11-12H2,1-4H3,(H-,25,26,28,29,30) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C)C(=O)OC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252273 | 517.618 | C24 H27 N3 O6 S2 | UBBXCQNRBROLTB-UHFFFAOYSA-N | InChI=1S/C24H27N3O6S2/c1-4-17(35-22-24(30)33-26-27(22)14-10-12-15(31-3)13-11-14)20(28)25-21-19(23(29)32-5-2)16-8-6-7-9-18(16)34-21/h10-13,17H,4-9H2,1-3H3,(H-,25,26,28,29,30) | CCC(C(=O)Nc1c(c2c(s1)CCCC2)C(=O)OCC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252594 | 517.618 | C24 H27 N3 O6 S2 | GOVXZNSXNTZHGZ-UHFFFAOYSA-N | InChI=1S/C24H27N3O6S2/c1-4-32-23(29)20-17-10-5-14(2)13-18(17)35-21(20)25-19(28)11-12-34-22-24(30)33-26-27(22)15-6-8-16(31-3)9-7-15/h6-9,14H,4-5,10-13H2,1-3H3,(H-,25,26,28,29,30) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])CC(CC2)C | |
| AKOS005252629 | 517.618 | C24 H27 N3 O6 S2 | QZVNQDNBUHBLTD-UHFFFAOYSA-N | InChI=1S/C24H27N3O6S2/c1-3-32-23(29)20-17-7-5-4-6-8-18(17)35-21(20)25-19(28)13-14-34-22-24(30)33-26-27(22)15-9-11-16(31-2)12-10-15/h9-12H,3-8,13-14H2,1-2H3,(H-,25,26,28,29,30) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])CCCCC2 | |
| AKOS005252630 | 517.618 | C24 H27 N3 O6 S2 | VGSSXFCTTYPUCL-UHFFFAOYSA-N | InChI=1S/C24H27N3O6S2/c1-31-16-11-9-15(10-12-16)27-22(24(30)33-26-27)34-14-13-19(28)25-21-20(23(29)32-2)17-7-5-3-4-6-8-18(17)35-21/h9-12H,3-8,13-14H2,1-2H3,(H-,25,26,28,29,30) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3c(c4c(s3)CCCCCC4)C(=O)OC | |
| AKOS005251010 | 465.502 | C24 H27 N5 O5 | ZDRLBNIGXQLRKL-UHFFFAOYSA-O | InChI=1S/C24H26N5O5/c1-28(2)15-7-14-25-23(31)20(26-22(30)17-8-5-4-6-9-17)16-21-24(32)34-27-29(21)18-10-12-19(33-3)13-11-18/h4-6,8-13,16H,7,14-15H2,1-3H3,(H,25,31)/q-1/p+1 | CN(C)CCCNC(=O)/C(=C/c1c(on[n+]1c2ccc(cc2)OC)[O-])/NC(=O)c3ccccc3 | |
| AKOS005254125 | 621.709 | C24 H27 N7 O7 S3 | ZAPNBKZHTNSXMM-UHFFFAOYSA-N | InChI=1S/C24H27N7O7S3/c1-4-30-23(33)19(13-21(32)26-16-7-11-17(12-8-16)40(25,34)35)31(24(30)39)14-20-22(38-28-29(20)3)27-41(36,37)18-9-5-15(2)6-10-18/h5-12,19H,4,13-14H2,1-3H3,(H3-,25,26,27,28,32,34,35) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)S(=O)(=O)N | |
| AKOS005251923 | 516.633 | C24 H28 N4 O5 S2 | XJICGLHHCRVSRN-UHFFFAOYSA-N | InChI=1S/C24H28N4O5S2/c1-4-17(35-22-24(31)33-26-27(22)3)20(29)25-21-19(23(30)32-5-2)16-11-12-28(14-18(16)34-21)13-15-9-7-6-8-10-15/h6-10,17H,4-5,11-14H2,1-3H3,(H-,25,26,29,30,31) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)Cc3ccccc3)C(=O)OCC)Sc4c(on[n+]4C)[O-] | |
| AKOS005253706 | 493.497 | C25 H15 N7 O3 S | CPZBXMNPBDJHCH-UHFFFAOYSA-N | InChI=1S/C25H15N7O3S/c26-11-15-17(14-7-4-8-16-13(14)9-10-29-16)18-19(27)22(36-24(18)30-23(15)28)21(33)20-25(34)35-31-32(20)12-5-2-1-3-6-12/h1-10H,(H5-,27,28,29,30,31,33,34) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(c(c(nc4s3)N)C#N)c5cccc6c5cc[nH]6)N | |
| AKOS005253488 | 524.511 | C25 H16 N8 O4 S | SFTZABUXOUYBOT-UHFFFAOYSA-N | InChI=1S/C25H16N8O4S/c1-33-19(25(35)37-32-33)16-13(10-26)21(28)31-24-17(16)18(27)20(38-24)22(34)29-12-8-6-11(7-9-12)23-30-14-4-2-3-5-15(14)36-23/h2-9H,1H3,(H5-,27,28,29,30,31,32,34,35) | C[n+]1c(c(on1)[O-])c2c(c(nc3c2c(c(s3)C(=O)Nc4ccc(cc4)c5nc6ccccc6o5)N)N)C#N | |
| AKOS005253624 | 524.511 | C25 H16 N8 O4 S | PGHQKRKGOHRRAC-UHFFFAOYSA-N | InChI=1S/C25H16N8O4S/c1-33-21(25(35)37-32-33)20-15(10-26)22(28)31-24(16(20)11-27)38-12-19(34)29-14-8-6-13(7-9-14)23-30-17-4-2-3-5-18(17)36-23/h2-9H,12H2,1H3,(H3-,28,29,30,31,32,34,35) | C[n+]1c(c(on1)[O-])c2c(c(nc(c2C#N)SCC(=O)Nc3ccc(cc3)c4nc5ccccc5o4)N)C#N | |
| AKOS005250431 | 542.486 | C25 H17 F3 N4 O5 S | GBTGXKSHEOCKTF-UHFFFAOYSA-N | InChI=1S/C25H17F3N4O5S/c1-35-16-7-3-14(4-8-16)20-11-19(25(26,27)28)18(12-29)23(30-20)38-13-21(33)22-24(34)37-31-32(22)15-5-9-17(36-2)10-6-15/h3-11H,13H2,1-2H3 | COc1ccc(cc1)c2cc(c(c(n2)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])C#N)C(F)(F)F | |
| AKOS005253722 | 542.486 | C25 H17 F3 N4 O5 S | JSMDJOFOACTUBJ-UHFFFAOYSA-N | InChI=1S/C25H17F3N4O5S/c1-35-14-7-3-12(4-8-14)17-11-16(25(26,27)28)18-19(29)22(38-23(18)30-17)21(33)20-24(34)37-31-32(20)13-5-9-15(36-2)10-6-13/h3-11H,1-2H3,(H2-,29,31,33,34) | COc1ccc(cc1)c2cc(c3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N)C(F)(F)F | |
| AKOS005250826 | 467.499 | C25 H17 N5 O3 S | QQZNTILXOTZEJT-UHFFFAOYSA-N | InChI=1S/C25H17N5O3S/c31-20(23-24(32)33-29-30(23)19-14-8-3-9-15-19)16-34-25-26-21(17-10-4-1-5-11-17)22(27-28-25)18-12-6-2-7-13-18/h1-15H,16H2 | c1ccc(cc1)c2c(nnc(n2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005250761 | 483.499 | C25 H17 N5 O4 S | FVOPXXRHAASOKQ-HMMYKYKNSA-N | InChI=1S/C25H17N5O4S/c31-21(22-24(33)34-28-30(22)19-12-5-2-6-13-19)16-35-25-27-20(15-17-9-7-8-14-26-17)23(32)29(25)18-10-3-1-4-11-18/h1-15H,16H2/b20-15+ | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccccn4)/C(=O)N3c5ccccc5 | |
| AKOS005250766 | 483.499 | C25 H17 N5 O4 S | CAQOZIZPZJBTPC-XSFVSMFZSA-N | InChI=1S/C25H17N5O4S/c31-21(22-24(33)34-28-30(22)19-11-5-2-6-12-19)16-35-25-27-20(14-17-8-7-13-26-15-17)23(32)29(25)18-9-3-1-4-10-18/h1-15H,16H2/b20-14+ | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4cccnc4)/C(=O)N3c5ccccc5 | |
| AKOS005250767 | 483.499 | C25 H17 N5 O4 S | CWDNNHYZLFRCEZ-HMMYKYKNSA-N | InChI=1S/C25H17N5O4S/c31-21(22-24(33)34-28-30(22)19-9-5-2-6-10-19)16-35-25-27-20(15-17-11-13-26-14-12-17)23(32)29(25)18-7-3-1-4-8-18/h1-15H,16H2/b20-15+ | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccncc4)/C(=O)N3c5ccccc5 | |
| AKOS005250815 | 454.5 | C25 H18 N4 O3 S | JJLLIRAODIFIIX-UHFFFAOYSA-N | InChI=1S/C25H18N4O3S/c30-20(23-24(31)32-28-29(23)19-14-8-3-9-15-19)16-33-25-26-21(17-10-4-1-5-11-17)22(27-25)18-12-6-2-7-13-18/h1-15H,16H2,(H-,26,27,28,30,31) | c1ccc(cc1)c2c(nc([nH]2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005250724 | 470.5 | C25 H18 N4 O4 S | NYDCESXSTACFDL-XSFVSMFZSA-N | InChI=1S/C25H18N4O4S/c1-28-22(24(32)33-27-28)21(30)15-34-25-26-20(23(31)29(25)18-11-3-2-4-12-18)14-17-10-7-9-16-8-5-6-13-19(16)17/h2-14H,15H2,1H3/b20-14+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3cccc4c3cccc4)/C(=O)N2c5ccccc5 | |
| AKOS005253678 | 470.5 | C25 H18 N4 O4 S | AGLNSJGFZIKDFM-UHFFFAOYSA-N | InChI=1S/C25H18N4O4S/c1-13-17(14(2)30)18(15-9-5-3-6-10-15)19-20(26)23(34-24(19)27-13)22(31)21-25(32)33-28-29(21)16-11-7-4-8-12-16/h3-12H,1-2H3,(H2-,26,28,31,32) | Cc1c(c(c2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccccc4)[O-])N)c5ccccc5)C(=O)C | |
| AKOS005250434 | 486.499 | C25 H18 N4 O5 S | IFNKBXUOOYMYIQ-UHFFFAOYSA-N | InChI=1S/C25H18N4O5S/c1-33-18-13-11-17(12-14-18)29-22(24(32)34-27-29)21(30)15-35-25-26-20-10-6-5-9-19(20)23(31)28(25)16-7-3-2-4-8-16/h2-14H,15H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nc4ccccc4c(=O)n3c5ccccc5 | |
| AKOS005250867 | 518.564 | C25 H18 N4 O5 S2 | CSDDGFWKDDUZQW-XSFVSMFZSA-N | InChI=1S/C25H18N4O5S2/c1-33-18-11-9-17(10-12-18)29-22(24(32)34-27-29)21(30)15-36-25-26-20(14-19-8-5-13-35-19)23(31)28(25)16-6-3-2-4-7-16/h2-14H,15H2,1H3/b20-14+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4cccs4)/C(=O)N3c5ccccc5 | |
| AKOS005250857 | 502.499 | C25 H18 N4 O6 S | ISLMXZANUPENSR-XSFVSMFZSA-N | InChI=1S/C25H18N4O6S/c1-33-18-11-9-17(10-12-18)29-22(24(32)35-27-29)21(30)15-36-25-26-20(14-19-8-5-13-34-19)23(31)28(25)16-6-3-2-4-7-16/h2-14H,15H2,1H3/b20-14+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccco4)/C(=O)N3c5ccccc5 | |
| AKOS005250833 | 482.514 | C25 H18 N6 O3 S | SUPJOYPTAPWANV-UHFFFAOYSA-N | InChI=1S/C25H18N6O3S/c1-2-15-8-10-16(11-9-15)21-18(12-26)23(28)29-24(19(21)13-27)35-14-20(32)22-25(33)34-30-31(22)17-6-4-3-5-7-17/h3-11H,2,14H2,1H3,(H2-,28,29,30,32,33) | CCc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])N)C#N | |
| AKOS005250465 | 498.513 | C25 H18 N6 O4 S | NGWVEKUISOEDJS-UHFFFAOYSA-N | InChI=1S/C25H18N6O4S/c1-14-3-5-15(6-4-14)21-18(11-26)23(28)29-24(19(21)12-27)36-13-20(32)22-25(33)35-30-31(22)16-7-9-17(34-2)10-8-16/h3-10H,13H2,1-2H3,(H2-,28,29,30,32,33) | Cc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N)C#N | |
| AKOS005254181 | 498.513 | C25 H18 N6 O4 S | SJSQLJDJRSJDDA-UHFFFAOYSA-N | InChI=1S/C25H18N6O4S/c1-12-3-5-13(6-4-12)17-16(11-26)23(28)29-24-18(17)19(27)22(36-24)21(32)20-25(33)35-30-31(20)14-7-9-15(34-2)10-8-14/h3-10H,1-2H3,(H4-,27,28,29,30,32,33) | Cc1ccc(cc1)c2c(c(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N)N)C#N | |
| AKOS005251037 | 474.896 | C25 H19 Cl N4 O4 | MZEIBAUALXWTGB-UHFFFAOYSA-O | InChI=1S/C25H18ClN4O4/c26-20-14-8-7-11-18(20)16-27-24(32)21(28-23(31)17-9-3-1-4-10-17)15-22-25(33)34-29-30(22)19-12-5-2-6-13-19/h1-15H,16H2,(H,27,32)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCc4ccccc4Cl | |
| AKOS005251053 | 458.441 | C25 H19 F N4 O4 | BLXAOKRNBVLURN-UHFFFAOYSA-O | InChI=1S/C25H18FN4O4/c26-19-13-11-17(12-14-19)16-27-24(32)21(28-23(31)18-7-3-1-4-8-18)15-22-25(33)34-29-30(22)20-9-5-2-6-10-20/h1-15H,16H2,(H,27,32)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCc4ccc(cc4)F | |
| AKOS005252485 | 469.515 | C25 H19 N5 O3 S | LEDIXVJATIPUBH-KGENOOAVSA-N | InChI=1S/C25H19N5O3S/c1-29-15-23(33-28-29)27-22(31)16-34-25-26-21(24(32)30(25)19-11-3-2-4-12-19)14-18-10-7-9-17-8-5-6-13-20(17)18/h2-15H,16H2,1H3/b21-14+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc4c3cccc4)/C(=O)N2c5ccccc5 | |
| AKOS005253232 | 513.528 | C25 H19 N7 O4 S | LVLZOPOIAKNWOI-UHFFFAOYSA-N | InChI=1S/C25H19N7O4S/c1-14(23(33)29-15-8-10-17(11-9-15)35-16-6-4-3-5-7-16)37-24-19(13-27)20(18(12-26)22(28)30-24)21-25(34)36-31-32(21)2/h3-11,14H,1-2H3,(H3-,28,29,30,31,33,34) | CC(C(=O)Nc1ccc(cc1)Oc2ccccc2)Sc3c(c(c(c(n3)N)C#N)c4c(on[n+]4C)[O-])C#N | |
| AKOS005251603 | 488.581 | C25 H20 N4 O3 S2 | HIYAVMSZEJNRAJ-UHFFFAOYSA-N | InChI=1S/C25H20N4O3S2/c26-14-20-19-12-11-17(16-7-3-1-4-8-16)13-21(19)34-23(20)27-22(30)15-33-24-25(31)32-28-29(24)18-9-5-2-6-10-18/h1-10,17H,11-13,15H2,(H-,27,28,30,31) | c1ccc(cc1)C2CCc3c(sc(c3C#N)NC(=O)CSc4c(on[n+]4c5ccccc5)[O-])C2 | |
| AKOS005251022 | 440.451 | C25 H20 N4 O4 | NGDMXORGDZYIFB-UHFFFAOYSA-O | InChI=1S/C25H19N4O4/c30-23(19-12-6-2-7-13-19)27-21(24(31)26-17-18-10-4-1-5-11-18)16-22-25(32)33-28-29(22)20-14-8-3-9-15-20/h1-16H,17H2,(H,26,31)/q-1/p+1 | c1ccc(cc1)CNC(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005250186 | 472.516 | C25 H20 N4 O4 S | LHSJIXOFRBDXQN-UHFFFAOYSA-N | InChI=1S/C25H20N4O4S/c1-32-18-10-8-17(9-11-18)29-22(25(31)33-28-29)23(30)27-24-20(14-26)19-12-7-16(13-21(19)34-24)15-5-3-2-4-6-15/h2-6,8-11,16H,7,12-13H2,1H3,(H-,27,28,30,31) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3c(c4c(s3)CC(CC4)c5ccccc5)C#N | |
| AKOS005250735 | 472.516 | C25 H20 N4 O4 S | CAKTXDNOHYBEJO-UHFFFAOYSA-N | InChI=1S/C25H20N4O4S/c1-15-4-6-16(7-5-15)19-12-21(17-8-10-18(32-3)11-9-17)27-24(20(19)13-26)34-14-22(30)23-25(31)33-28-29(23)2/h4-12H,14H2,1-3H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)c3c(on[n+]3C)[O-])c4ccc(cc4)OC | |
| AKOS005251912 | 472.516 | C25 H20 N4 O4 S | XOIYCTFCSZNFAW-UHFFFAOYSA-N | InChI=1S/C25H20N4O4S/c1-2-21(34-24-25(31)33-28-29(24)18-8-4-3-5-9-18)22(30)26-17-14-12-16(13-15-17)23-27-19-10-6-7-11-20(19)32-23/h3-15,21H,2H2,1H3,(H-,26,27,28,30,31) | CCC(C(=O)Nc1ccc(cc1)c2nc3ccccc3o2)Sc4c(on[n+]4c5ccccc5)[O-] | |
| AKOS005253850 | 472.516 | C25 H20 N4 O4 S | KKYWAICMNULQOR-UHFFFAOYSA-N | InChI=1S/C25H20N4O4S/c1-13-4-6-14(7-5-13)17-12-18(15-8-10-16(32-3)11-9-15)27-24-19(17)20(26)23(34-24)22(30)21-25(31)33-28-29(21)2/h4-12H,1-3H3,(H2-,26,28,30,31) | Cc1ccc(cc1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4C)[O-])N)c5ccc(cc5)OC | |
| AKOS005254187 | 472.516 | C25 H20 N4 O4 S | BCAWIZRATXCIPT-UHFFFAOYSA-N | InChI=1S/C25H20N4O4S/c1-13-4-6-15(7-5-13)20-14(2)12-18-19(26)23(34-24(18)27-20)22(30)21-25(31)33-28-29(21)16-8-10-17(32-3)11-9-16/h4-12H,1-3H3,(H2-,26,28,30,31) | Cc1ccc(cc1)c2c(cc3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N)C | |
| AKOS005250727 | 488.515 | C25 H20 N4 O5 S | CCYVJEDFQSEIPX-UHFFFAOYSA-N | InChI=1S/C25H20N4O5S/c1-29-22(25(31)34-28-29)20(30)14-35-24-18(13-26)17(12-19(27-24)15-8-5-4-6-9-15)16-10-7-11-21(32-2)23(16)33-3/h4-12H,14H2,1-3H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cccc(c4OC)OC)C#N | |
| AKOS005250756 | 488.515 | C25 H20 N4 O5 S | PAFZBGLJDPMRMT-UHFFFAOYSA-N | InChI=1S/C25H20N4O5S/c1-29-23(25(31)34-28-29)21(30)14-35-24-19(13-26)17(12-20(27-24)15-7-5-4-6-8-15)18-11-16(32-2)9-10-22(18)33-3/h4-12H,14H2,1-3H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cc(ccc4OC)OC)C#N | |
| AKOS005251792 | 488.515 | C25 H20 N4 O5 S | YHBLDLFULBCSFG-UHFFFAOYSA-N | InChI=1S/C25H20N4O5S/c1-15(35-24-25(31)34-28-29(24)18-11-13-19(32-2)14-12-18)22(30)26-17-9-7-16(8-10-17)23-27-20-5-3-4-6-21(20)33-23/h3-15H,1-2H3,(H-,26,27,28,30,31) | CC(C(=O)Nc1ccc(cc1)c2nc3ccccc3o2)Sc4c(on[n+]4c5ccc(cc5)OC)[O-] | |
| AKOS005252197 | 488.515 | C25 H20 N4 O5 S | LHTGYOWUTMOKKZ-UHFFFAOYSA-N | InChI=1S/C25H20N4O5S/c1-32-19-12-10-18(11-13-19)29-24(25(31)34-28-29)35-15-14-22(30)26-17-8-6-16(7-9-17)23-27-20-4-2-3-5-21(20)33-23/h2-13H,14-15H2,1H3,(H-,26,27,28,30,31) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3ccc(cc3)c4nc5ccccc5o4 | |
| AKOS005253835 | 488.515 | C25 H20 N4 O5 S | FMLBKKWKHILBOP-UHFFFAOYSA-N | InChI=1S/C25H20N4O5S/c1-29-21(25(31)34-28-29)22(30)23-20(26)19-16(15-11-14(32-2)9-10-18(15)33-3)12-17(27-24(19)35-23)13-7-5-4-6-8-13/h4-12H,1-3H3,(H2-,26,28,30,31) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4ccccc4)c5cc(ccc5OC)OC)N | |
| AKOS005253877 | 488.515 | C25 H20 N4 O5 S | GXZMQGDTSFYJHJ-UHFFFAOYSA-N | InChI=1S/C25H20N4O5S/c1-29-21(25(31)34-28-29)22(30)23-20(26)19-15(14-9-10-17(32-2)18(11-14)33-3)12-16(27-24(19)35-23)13-7-5-4-6-8-13/h4-12H,1-3H3,(H2-,26,28,30,31) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4ccccc4)c5ccc(c(c5)OC)OC)N | |
| AKOS005253908 | 488.515 | C25 H20 N4 O5 S | YATXPJKNMVLBBC-UHFFFAOYSA-N | InChI=1S/C25H20N4O5S/c1-29-20(25(31)34-28-29)21(30)23-19(26)18-15(14-10-7-11-17(32-2)22(14)33-3)12-16(27-24(18)35-23)13-8-5-4-6-9-13/h4-12H,1-3H3,(H2-,26,28,30,31) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4ccccc4)c5cccc(c5OC)OC)N | |
| AKOS005254087 | 520.58 | C25 H20 N4 O5 S2 | HZAISTRJQVELMY-UHFFFAOYSA-N | InChI=1S/C25H20N4O5S2/c1-11-5-10-16(35-11)18-17(13(3)30)12(2)27-24-19(18)20(26)23(36-24)22(31)21-25(32)34-28-29(21)14-6-8-15(33-4)9-7-14/h5-10H,1-4H3,(H2-,26,28,31,32) | Cc1ccc(s1)c2c3c(c(sc3nc(c2C(=O)C)C)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N | |
| AKOS005252457 | 455.532 | C25 H21 N5 O2 S | DCRMMXRREMBBKF-UHFFFAOYSA-N | InChI=1S/C25H21N5O2S/c1-3-30-15-24(32-29-30)28-23(31)16-33-25-21(14-26)20(18-11-9-17(2)10-12-18)13-22(27-25)19-7-5-4-6-8-19/h4-13,15H,3,16H2,1-2H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4ccc(cc4)C)C#N | |
| AKOS005252869 | 455.532 | C25 H21 N5 O2 S | CLKPSRIYPOEFIV-UHFFFAOYSA-N | InChI=1S/C25H21N5O2S/c1-17(2)30-15-24(32-29-30)28-23(31)16-33-25-21(14-26)20(18-9-5-3-6-10-18)13-22(27-25)19-11-7-4-8-12-19/h3-13,15,17H,16H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4ccccc4)C#N | |
| AKOS005252409 | 471.531 | C25 H21 N5 O3 S | VDMQVOBMFJTQCE-UHFFFAOYSA-N | InChI=1S/C25H21N5O3S/c1-16-4-6-17(7-5-16)20-12-22(18-8-10-19(32-3)11-9-18)27-25(21(20)13-26)34-15-23(31)28-24-14-30(2)29-33-24/h4-12,14H,15H2,1-3H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)C)c4ccc(cc4)OC | |
| AKOS005252509 | 471.531 | C25 H21 N5 O3 S | ILOXGFSYPQZVAP-UHFFFAOYSA-N | InChI=1S/C25H21N5O3S/c1-3-30-15-24(33-29-30)28-23(31)16-34-25-21(14-26)20(17-9-11-19(32-2)12-10-17)13-22(27-25)18-7-5-4-6-8-18/h4-13,15H,3,16H2,1-2H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4ccc(cc4)OC)C#N | |
| AKOS005253416 | 471.531 | C25 H21 N5 O3 S | HRRSCIOAQCEPDR-UHFFFAOYSA-N | InChI=1S/C25H21N5O3S/c1-32-13-12-30-16-24(33-29-30)28-23(31)17-34-25-21(15-26)20(18-8-4-2-5-9-18)14-22(27-25)19-10-6-3-7-11-19/h2-11,14,16H,12-13,17H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4ccccc4)C#N | |
| AKOS005251611 | 503.596 | C25 H21 N5 O3 S2 | DXJWBOPYXHHBPI-UHFFFAOYSA-N | InChI=1S/C25H21N5O3S2/c26-13-20-19-11-12-29(14-17-7-3-1-4-8-17)15-21(19)35-23(20)27-22(31)16-34-24-25(32)33-28-30(24)18-9-5-2-6-10-18/h1-10H,11-12,14-16H2,(H-,27,28,31,32) | c1ccc(cc1)CN2CCc3c(sc(c3C#N)NC(=O)CSc4c(on[n+]4c5ccccc5)[O-])C2 | |
| AKOS005250194 | 487.53 | C25 H21 N5 O4 S | YAMQOKWNXMBSCS-UHFFFAOYSA-N | InChI=1S/C25H21N5O4S/c1-33-18-9-7-17(8-10-18)30-22(25(32)34-28-30)23(31)27-24-20(13-26)19-11-12-29(15-21(19)35-24)14-16-5-3-2-4-6-16/h2-10H,11-12,14-15H2,1H3,(H-,27,28,31,32) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3c(c4c(s3)CN(CC4)Cc5ccccc5)C#N | |
| AKOS005252410 | 487.53 | C25 H21 N5 O4 S | SLZCARXUHLGMER-UHFFFAOYSA-N | InChI=1S/C25H21N5O4S/c1-30-14-24(34-29-30)28-23(31)15-35-25-20(13-26)18(12-21(27-25)16-7-5-4-6-8-16)19-11-17(32-2)9-10-22(19)33-3/h4-12,14H,15H2,1-3H3 | C[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cc(ccc4OC)OC)C#N | |
| AKOS005252536 | 487.53 | C25 H21 N5 O4 S | ZFIYLQJMPQHEFA-UHFFFAOYSA-N | InChI=1S/C25H21N5O4S/c1-30-14-23(34-29-30)28-22(31)15-35-25-19(13-26)18(12-20(27-25)16-8-5-4-6-9-16)17-10-7-11-21(32-2)24(17)33-3/h4-12,14H,15H2,1-3H3 | C[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cccc(c4OC)OC)C#N | |
| AKOS005252266 | 519.595 | C25 H21 N5 O4 S2 | NAEQQOXXYUSYHU-UHFFFAOYSA-N | InChI=1S/C25H21N5O4S2/c1-3-19(35-24-25(33)34-29-30(24)17-12-8-5-9-13-17)21(31)28-23-18(14-26)15(2)20(36-23)22(32)27-16-10-6-4-7-11-16/h4-13,19H,3H2,1-2H3,(H2-,27,28,29,31,32,33) | CCC(C(=O)Nc1c(c(c(s1)C(=O)Nc2ccccc2)C)C#N)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250995 | 471.465 | C25 H21 N5 O5 | MGTXWAXERDESES-UHFFFAOYSA-O | InChI=1S/C25H20N5O5/c1-34-20-11-9-19(10-12-20)30-22(25(33)35-29-30)14-21(28-23(31)18-7-3-2-4-8-18)24(32)27-16-17-6-5-13-26-15-17/h2-15H,16H2,1H3,(H,27,32)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCc3cccnc3)\NC(=O)c4ccccc4 | |
| AKOS005251686 | 535.595 | C25 H21 N5 O5 S2 | WEUGBESMVZZYLL-UHFFFAOYSA-N | InChI=1S/C25H21N5O5S2/c1-14-19(13-26)23(37-20(14)22(32)27-16-7-5-4-6-8-16)28-21(31)15(2)36-24-25(33)35-29-30(24)17-9-11-18(34-3)12-10-17/h4-12,15H,1-3H3,(H2-,27,28,29,31,32,33) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)C(C)Sc3c(on[n+]3c4ccc(cc4)OC)[O-])C#N | |
| AKOS005252616 | 535.595 | C25 H21 N5 O5 S2 | UGJQIVPJSFTQKT-UHFFFAOYSA-N | InChI=1S/C25H21N5O5S2/c1-15-19(14-26)23(37-21(15)22(32)27-16-6-4-3-5-7-16)28-20(31)12-13-36-24-25(33)35-29-30(24)17-8-10-18(34-2)11-9-17/h3-11H,12-13H2,1-2H3,(H2-,27,28,29,31,32,33) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])C#N | |
| AKOS005253091 | 540.997 | C25 H22 Cl F N6 O3 S | MXCXXJPDSHDSET-STZFKDTASA-N | InChI=1S/C25H22ClFN6O3S/c26-19-10-7-11-20(27)18(19)14-21-24(35)33(17-8-3-1-4-9-17)25(28-21)37-16-22(34)29-23-15-32(30-36-23)31-12-5-2-6-13-31/h1,3-4,7-11,14-15H,2,5-6,12-13,16H2/b21-14- | c1ccc(cc1)N2C(=O)/C(=C/c3c(cccc3Cl)F)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005253108 | 557.452 | C25 H22 Cl2 N6 O3 S | ZQAVADMXDZWOSZ-XSFVSMFZSA-N | InChI=1S/C25H22Cl2N6O3S/c26-19-11-7-8-17(23(19)27)14-20-24(35)33(18-9-3-1-4-10-18)25(28-20)37-16-21(34)29-22-15-32(30-36-22)31-12-5-2-6-13-31/h1,3-4,7-11,14-15H,2,5-6,12-13,16H2/b20-14+ | c1ccc(cc1)N2C(=O)/C(=C\c3cccc(c3Cl)Cl)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005253114 | 557.452 | C25 H22 Cl2 N6 O3 S | USLAQZLTFOEBFN-FYJGNVAPSA-N | InChI=1S/C25H22Cl2N6O3S/c26-18-10-9-17(20(27)14-18)13-21-24(35)33(19-7-3-1-4-8-19)25(28-21)37-16-22(34)29-23-15-32(30-36-23)31-11-5-2-6-12-31/h1,3-4,7-10,13-15H,2,5-6,11-12,16H2/b21-13+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccc(cc3Cl)Cl)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005253119 | 557.452 | C25 H22 Cl2 N6 O3 S | PTJCGWKFLWAYKB-STZFKDTASA-N | InChI=1S/C25H22Cl2N6O3S/c26-19-10-7-11-20(27)18(19)14-21-24(35)33(17-8-3-1-4-9-17)25(28-21)37-16-22(34)29-23-15-32(30-36-23)31-12-5-2-6-13-31/h1,3-4,7-11,14-15H,2,5-6,12-13,16H2/b21-14- | c1ccc(cc1)N2C(=O)/C(=C/c3c(cccc3Cl)Cl)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005251572 | 538.595 | C25 H22 N4 O6 S2 | GAJBBUARRZWPJV-UHFFFAOYSA-N | InChI=1S/C25H22N4O6S2/c1-3-34-24(32)19-15(2)20(21(31)26-16-10-6-4-7-11-16)37-22(19)27-18(30)14-36-23-25(33)35-28-29(23)17-12-8-5-9-13-17/h4-13H,3,14H2,1-2H3,(H2-,26,27,28,30,31,32,33) | CCOC(=O)c1c(c(sc1NC(=O)CSc2c(on[n+]2c3ccccc3)[O-])C(=O)Nc4ccccc4)C | |
| AKOS005251678 | 538.595 | C25 H22 N4 O6 S2 | FYGZHOZHPTYTRG-UHFFFAOYSA-N | InChI=1S/C25H22N4O6S2/c1-14-18(24(32)34-3)22(37-19(14)21(31)26-16-10-6-4-7-11-16)27-20(30)15(2)36-23-25(33)35-28-29(23)17-12-8-5-9-13-17/h4-13,15H,1-3H3,(H2-,26,27,28,30,31,32,33) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)C(C)Sc3c(on[n+]3c4ccccc4)[O-])C(=O)OC | |
| AKOS005252592 | 538.595 | C25 H22 N4 O6 S2 | BRQWWXNMPXZCIS-UHFFFAOYSA-N | InChI=1S/C25H22N4O6S2/c1-15-19(24(32)34-2)22(37-20(15)21(31)26-16-9-5-3-6-10-16)27-18(30)13-14-36-23-25(33)35-28-29(23)17-11-7-4-8-12-17/h3-12H,13-14H2,1-2H3,(H2-,26,27,28,30,31,32,33) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])C(=O)OC | |
| AKOS005250211 | 522.53 | C25 H22 N4 O7 S | UMFHXXFCBVHSMU-UHFFFAOYSA-N | InChI=1S/C25H22N4O7S/c1-4-35-24(32)18-14(2)20(22(31)26-15-8-6-5-7-9-15)37-23(18)27-21(30)19-25(33)36-28-29(19)16-10-12-17(34-3)13-11-16/h5-13H,4H2,1-3H3,(H2-,26,27,28,30,31,32,33) | CCOC(=O)c1c(c(sc1NC(=O)c2c(on[n+]2c3ccc(cc3)OC)[O-])C(=O)Nc4ccccc4)C | |
| AKOS005251389 | 554.595 | C25 H22 N4 O7 S2 | AWAHDIVCOXDHFC-UHFFFAOYSA-N | InChI=1S/C25H22N4O7S2/c1-14-19(24(32)35-3)22(38-20(14)21(31)26-15-7-5-4-6-8-15)27-18(30)13-37-23-25(33)36-28-29(23)16-9-11-17(34-2)12-10-16/h4-12H,13H2,1-3H3,(H2-,26,27,28,30,31,32,33) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])C(=O)OC | |
| AKOS005252736 | 470.546 | C25 H22 N6 O2 S | SNDVQMKTGOZJPZ-UHFFFAOYSA-N | InChI=1S/C25H22N6O2S/c1-17-9-11-18(12-10-17)20-13-22(19-7-5-4-6-8-19)27-25(21(20)14-26)34-16-23(32)28-24-15-31(29-33-24)30(2)3/h4-13,15H,16H2,1-3H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N(C)C)c4ccccc4 | |
| AKOS005252752 | 486.546 | C25 H22 N6 O3 S | IWYBXADKYPZERR-UHFFFAOYSA-N | InChI=1S/C25H22N6O3S/c1-30(2)31-15-24(34-29-31)28-23(32)16-35-25-21(14-26)20(17-9-11-19(33-3)12-10-17)13-22(27-25)18-7-5-4-6-8-18/h4-13,15H,16H2,1-3H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4ccc(cc4)OC)C#N | |
| AKOS005253510 | 518.544 | C25 H22 N6 O5 S | KKRKBVOLLQLKPX-UHFFFAOYSA-N | InChI=1S/C25H22N6O5S/c1-29-19(24(34)36-28-29)13-30-18(23(33)31(25(30)37)16-10-11-16)12-21(32)26-15-8-6-14(7-9-15)22-27-17-4-2-3-5-20(17)35-22/h2-9,16,18H,10-13H2,1H3,(H-,26,27,28,32,34) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C3CC3)CC(=O)Nc4ccc(cc4)c5nc6ccccc6o5 | |
| AKOS005252959 | 534.544 | C25 H22 N6 O6 S | UTAOMLMVAHTZKK-XDHOZWIPSA-N | InChI=1S/C25H22N6O6S/c32-22(27-23-14-30(28-37-23)29-8-10-34-11-9-29)15-38-25-26-19(24(33)31(25)18-4-2-1-3-5-18)12-17-6-7-20-21(13-17)36-16-35-20/h1-7,12-14H,8-11,15-16H2/b19-12+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccc4c(c3)OCO4)/N=C2SCC(=O)[N-]c5c[n+](no5)N6CCOCC6 | |
| AKOS005253110 | 567.458 | C25 H23 Br N6 O3 S | GIEXVKVTYRPQSQ-RCCKNPSSSA-N | InChI=1S/C25H23BrN6O3S/c26-19-9-7-8-18(14-19)15-21-24(34)32(20-10-3-1-4-11-20)25(27-21)36-17-22(33)28-23-16-31(29-35-23)30-12-5-2-6-13-30/h1,3-4,7-11,14-16H,2,5-6,12-13,17H2/b21-15+ | c1ccc(cc1)N2C(=O)/C(=C\c3cccc(c3)Br)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005253111 | 567.458 | C25 H23 Br N6 O3 S | BYGBPXHEBSOYEB-RCCKNPSSSA-N | InChI=1S/C25H23BrN6O3S/c26-19-11-9-18(10-12-19)15-21-24(34)32(20-7-3-1-4-8-20)25(27-21)36-17-22(33)28-23-16-31(29-35-23)30-13-5-2-6-14-30/h1,3-4,7-12,15-16H,2,5-6,13-14,17H2/b21-15+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccc(cc3)Br)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005253991 | 583.457 | C25 H23 Br N6 O4 S | DYGYGPFOBRZUSP-UHFFFAOYSA-N | InChI=1S/C25H23BrN6O4S/c1-30-20(23(36-29-30)28-22(34)15-5-3-2-4-6-15)14-31-19(24(35)32(25(31)37)18-11-12-18)13-21(33)27-17-9-7-16(26)8-10-17/h2-10,18-19H,11-14H2,1H3,(H-,27,28,29,33,34) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)Br | |
| AKOS005253092 | 523.007 | C25 H23 Cl N6 O3 S | BJVMGQJOXDXWFZ-RCCKNPSSSA-N | InChI=1S/C25H23ClN6O3S/c26-20-12-6-5-9-18(20)15-21-24(34)32(19-10-3-1-4-11-19)25(27-21)36-17-22(33)28-23-16-31(29-35-23)30-13-7-2-8-14-30/h1,3-6,9-12,15-16H,2,7-8,13-14,17H2/b21-15+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccccc3Cl)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005253097 | 523.007 | C25 H23 Cl N6 O3 S | BDHNQLWVKQQQKY-RCCKNPSSSA-N | InChI=1S/C25H23ClN6O3S/c26-19-9-7-8-18(14-19)15-21-24(34)32(20-10-3-1-4-11-20)25(27-21)36-17-22(33)28-23-16-31(29-35-23)30-12-5-2-6-13-30/h1,3-4,7-11,14-16H,2,5-6,12-13,17H2/b21-15+ | c1ccc(cc1)N2C(=O)/C(=C\c3cccc(c3)Cl)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005253098 | 523.007 | C25 H23 Cl N6 O3 S | RBJWQGZFWNNIEK-RCCKNPSSSA-N | InChI=1S/C25H23ClN6O3S/c26-19-11-9-18(10-12-19)15-21-24(34)32(20-7-3-1-4-8-20)25(27-21)36-17-22(33)28-23-16-31(29-35-23)30-13-5-2-6-14-30/h1,3-4,7-12,15-16H,2,5-6,13-14,17H2/b21-15+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccc(cc3)Cl)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005253988 | 539.006 | C25 H23 Cl N6 O4 S | LCCSPSKJZSNWEN-UHFFFAOYSA-N | InChI=1S/C25H23ClN6O4S/c1-30-20(23(36-29-30)28-22(34)15-5-3-2-4-6-15)14-31-19(24(35)32(25(31)37)18-11-12-18)13-21(33)27-17-9-7-16(26)8-10-17/h2-10,18-19H,11-14H2,1H3,(H-,27,28,29,33,34) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)Cl | |
| AKOS005253120 | 506.552 | C25 H23 F N6 O3 S | BYZBUORBQIKYNI-RCCKNPSSSA-N | InChI=1S/C25H23FN6O3S/c26-20-12-6-5-9-18(20)15-21-24(34)32(19-10-3-1-4-11-19)25(27-21)36-17-22(33)28-23-16-31(29-35-23)30-13-7-2-8-14-30/h1,3-6,9-12,15-16H,2,7-8,13-14,17H2/b21-15+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccccc3F)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005253121 | 506.552 | C25 H23 F N6 O3 S | LIWLQWKUMOAYAB-RCCKNPSSSA-N | InChI=1S/C25H23FN6O3S/c26-19-11-9-18(10-12-19)15-21-24(34)32(20-7-3-1-4-8-20)25(27-21)36-17-22(33)28-23-16-31(29-35-23)30-13-5-2-6-14-30/h1,3-4,7-12,15-16H,2,5-6,13-14,17H2/b21-15+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccc(cc3)F)/N=C2SCC(=O)[N-]c4c[n+](no4)N5CCCCC5 | |
| AKOS005254004 | 522.551 | C25 H23 F N6 O4 S | CHHJLHVEGAUFEV-UHFFFAOYSA-N | InChI=1S/C25H23FN6O4S/c1-30-20(23(36-29-30)28-22(34)15-5-3-2-4-6-15)14-31-19(24(35)32(25(31)37)18-11-12-18)13-21(33)27-17-9-7-16(26)8-10-17/h2-10,18-19H,11-14H2,1H3,(H-,27,28,29,33,34) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)F | |
| AKOS005253959 | 576.548 | C25 H23 F3 N6 O5 S | DDEAPKRNVBFKJA-UHFFFAOYSA-N | InChI=1S/C25H23F3N6O5S/c1-3-33-23(37)18(13-20(35)29-16-9-11-17(12-10-16)38-25(26,27)28)34(24(33)40)14-19-22(39-31-32(19)2)30-21(36)15-7-5-4-6-8-15/h4-12,18H,3,13-14H2,1-2H3,(H-,29,30,31,35,36) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)OC(F)(F)F | |
| AKOS005253998 | 630.457 | C25 H23 I N6 O4 S | DMHKGDNKGQGZDH-UHFFFAOYSA-N | InChI=1S/C25H23IN6O4S/c1-30-20(23(36-29-30)28-22(34)15-5-3-2-4-6-15)14-31-19(24(35)32(25(31)37)18-11-12-18)13-21(33)27-17-9-7-16(26)8-10-17/h2-10,18-19H,11-14H2,1H3,(H-,27,28,29,33,34) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)I | |
| AKOS005252074 | 477.532 | C25 H23 N3 O5 S | SVDMKBYJKJGCHP-UHFFFAOYSA-N | InChI=1S/C25H23N3O5S/c1-3-22(34-24-25(30)33-27-28(24)18-11-15-19(31-2)16-12-18)23(29)26-17-9-13-21(14-10-17)32-20-7-5-4-6-8-20/h4-16,22H,3H2,1-2H3,(H-,26,27,29,30) | CCC(C(=O)Nc1ccc(cc1)Oc2ccccc2)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252830 | 473.547 | C25 H23 N5 O3 S | XMYIQMKACKAVMC-VUPRMNMUSA-N | InChI=1S/C25H23N5O3S/c1-18(2)29-16-23(33-28-29)27-22(31)17-34-25-26-21(15-9-12-19-10-5-3-6-11-19)24(32)30(25)20-13-7-4-8-14-20/h3-16,18H,17H2,1-2H3/b12-9+,21-15+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/C=C/c3ccccc3)/C(=O)N2c4ccccc4 | |
| AKOS005253349 | 489.546 | C25 H23 N5 O4 S | IEOQXXZBBRYIAU-DYTMQZIQSA-N | InChI=1S/C25H23N5O4S/c1-33-16-15-29-17-23(34-28-29)27-22(31)18-35-25-26-21(14-8-11-19-9-4-2-5-10-19)24(32)30(25)20-12-6-3-7-13-20/h2-14,17H,15-16,18H2,1H3/b11-8+,21-14+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/C=C/c3ccccc3)/C(=O)N2c4ccccc4 | |
| AKOS005253997 | 549.558 | C25 H23 N7 O6 S | CMZVCPLXTDNVGF-UHFFFAOYSA-N | InChI=1S/C25H23N7O6S/c1-29-20(23(38-28-29)27-22(34)15-5-3-2-4-6-15)14-30-19(24(35)31(25(30)39)17-11-12-17)13-21(33)26-16-7-9-18(10-8-16)32(36)37/h2-10,17,19H,11-14H2,1H3,(H-,26,27,28,33,34) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)N(=O)=O | |
| AKOS005219469 | 429.451 | C25 H24 N3 O2 P | SNQBKXHMNRFQDL-UHFFFAOYSA-N | InChI=1S/C25H24N3O2P/c1-2-3-19-28-25(24(30-27-28)26-23(29)20-13-7-4-8-14-20)31(21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-18H,2-3,19H2,1H3 | CCCC[n+]1c(c(on1)[N-]C(=O)c2ccccc2)P(c3ccccc3)c4ccccc4 | |
| AKOS005251257 | 476.481 | C25 H24 N4 O6 | FIDMDCQVPPYNCY-UHFFFAOYSA-N | InChI=1S/C25H24N4O6/c1-15(30)16-3-5-18(6-4-16)28-23(31)13-21(24(28)32)27(17-7-8-17)14-22-25(33)35-26-29(22)19-9-11-20(34-2)12-10-19/h3-6,9-12,17,21H,7-8,13-14H2,1-2H3 | CC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)N(Cc3c(on[n+]3c4ccc(cc4)OC)[O-])C5CC5 | |
| AKOS005251371 | 476.481 | C25 H24 N4 O6 | BLWGQTNHPYJQLJ-UHFFFAOYSA-N | InChI=1S/C25H24N4O6/c1-2-34-24(32)16-8-10-18(11-9-16)28-22(30)14-20(23(28)31)27(17-12-13-17)15-21-25(33)35-26-29(21)19-6-4-3-5-7-19/h3-11,17,20H,2,12-15H2,1H3 | CCOC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)N(Cc3c(on[n+]3c4ccccc4)[O-])C5CC5 | |
| AKOS005253116 | 488.561 | C25 H24 N6 O3 S | FXFCTVBSTWYRGS-LTGZKZEYSA-N | InChI=1S/C25H24N6O3S/c32-22(27-23-17-30(28-34-23)29-14-8-3-9-15-29)18-35-25-26-21(16-19-10-4-1-5-11-19)24(33)31(25)20-12-6-2-7-13-20/h1-2,4-7,10-13,16-17H,3,8-9,14-15,18H2/b21-16+ | c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005252974 | 504.561 | C25 H24 N6 O4 S | QCXABWUXLCUKFB-RCCKNPSSSA-N | InChI=1S/C25H24N6O4S/c1-18-7-5-6-8-19(18)15-21-24(33)31(20-9-3-2-4-10-20)25(26-21)36-17-22(32)27-23-16-30(28-35-23)29-11-13-34-14-12-29/h2-10,15-16H,11-14,17H2,1H3/b21-15+ | Cc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005252980 | 504.561 | C25 H24 N6 O4 S | UWDUMIZHGRTJPL-RCCKNPSSSA-N | InChI=1S/C25H24N6O4S/c1-18-6-5-7-19(14-18)15-21-24(33)31(20-8-3-2-4-9-20)25(26-21)36-17-22(32)27-23-16-30(28-35-23)29-10-12-34-13-11-29/h2-9,14-16H,10-13,17H2,1H3/b21-15+ | Cc1cccc(c1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005252981 | 504.561 | C25 H24 N6 O4 S | PSLIESOGZFCMLR-RCCKNPSSSA-N | InChI=1S/C25H24N6O4S/c1-18-7-9-19(10-8-18)15-21-24(33)31(20-5-3-2-4-6-20)25(26-21)36-17-22(32)27-23-16-30(28-35-23)29-11-13-34-14-12-29/h2-10,15-16H,11-14,17H2,1H3/b21-15+ | Cc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005253971 | 504.561 | C25 H24 N6 O4 S | FZYZIILBJOOOPD-UHFFFAOYSA-N | InChI=1S/C25H24N6O4S/c1-29-20(23(35-28-29)27-22(33)16-8-4-2-5-9-16)15-30-19(24(34)31(25(30)36)18-12-13-18)14-21(32)26-17-10-6-3-7-11-17/h2-11,18-19H,12-15H2,1H3,(H-,26,27,28,32,33) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccccc5 | |
| AKOS005253500 | 536.626 | C25 H24 N6 O4 S2 | JJHQPXPIHCEDGP-UHFFFAOYSA-N | InChI=1S/C25H24N6O4S2/c1-4-30-23(33)18(31(25(30)36)13-19-24(34)35-28-29(19)3)12-21(32)26-16-8-6-15(7-9-16)22-27-17-10-5-14(2)11-20(17)37-22/h5-11,18H,4,12-13H2,1-3H3,(H-,26,27,28,32,34) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)c4nc5ccc(cc5s4)C | |
| AKOS005252979 | 520.56 | C25 H24 N6 O5 S | MKYDCGWAONRXJC-RCCKNPSSSA-N | InChI=1S/C25H24N6O5S/c1-34-20-9-7-18(8-10-20)15-21-24(33)31(19-5-3-2-4-6-19)25(26-21)37-17-22(32)27-23-16-30(28-36-23)29-11-13-35-14-12-29/h2-10,15-16H,11-14,17H2,1H3/b21-15+ | COc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005252985 | 520.56 | C25 H24 N6 O5 S | HLHPKLKEDCZJHF-HMMYKYKNSA-N | InChI=1S/C25H24N6O5S/c1-34-21-10-6-5-7-18(21)15-20-24(33)31(19-8-3-2-4-9-19)25(26-20)37-17-22(32)27-23-16-30(28-36-23)29-11-13-35-14-12-29/h2-10,15-16H,11-14,17H2,1H3/b20-15+ | COc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005252990 | 520.56 | C25 H24 N6 O5 S | IBZONXAJCFKYBA-RCCKNPSSSA-N | InChI=1S/C25H24N6O5S/c1-34-20-9-5-6-18(14-20)15-21-24(33)31(19-7-3-2-4-8-19)25(26-21)37-17-22(32)27-23-16-30(28-36-23)29-10-12-35-13-11-29/h2-9,14-16H,10-13,17H2,1H3/b21-15+ | COc1cccc(c1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005253936 | 520.56 | C25 H24 N6 O5 S | CCMXUIYSDGEFEC-UHFFFAOYSA-N | InChI=1S/C25H24N6O5S/c1-15(32)16-9-11-18(12-10-16)26-21(33)13-19-24(35)29(2)25(37)31(19)14-20-23(36-28-30(20)3)27-22(34)17-7-5-4-6-8-17/h4-12,19H,13-14H2,1-3H3,(H-,26,27,28,32,33,34) | CC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)C | |
| AKOS005254036 | 536.56 | C25 H24 N6 O6 S | GPUMPVYRVUSUMQ-UHFFFAOYSA-N | InChI=1S/C25H24N6O6S/c1-29-23(34)18(13-20(32)26-17-11-9-16(10-12-17)24(35)36-3)31(25(29)38)14-19-22(37-28-30(19)2)27-21(33)15-7-5-4-6-8-15/h4-12,18H,13-14H2,1-3H3,(H-,26,27,28,32,33,35) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)C(=O)OC | |
| AKOS005254034 | 633.537 | C25 H25 Br N6 O5 S2 | LELYDIODYLFSJC-UHFFFAOYSA-N | InChI=1S/C25H25BrN6O5S2/c1-15-3-11-19(12-4-15)39(35,36)28-23-21(30(2)29-37-23)14-31-20(24(34)32(25(31)38)18-9-10-18)13-22(33)27-17-7-5-16(26)6-8-17/h3-8,11-12,18,20H,9-10,13-14H2,1-2H3,(H-,27,28,29,33) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)Br | |
| AKOS005254120 | 589.086 | C25 H25 Cl N6 O5 S2 | FKRBCKGUACSBEC-UHFFFAOYSA-N | InChI=1S/C25H25ClN6O5S2/c1-15-3-11-19(12-4-15)39(35,36)28-23-21(30(2)29-37-23)14-31-20(24(34)32(25(31)38)18-9-10-18)13-22(33)27-17-7-5-16(26)6-8-17/h3-8,11-12,18,20H,9-10,13-14H2,1-2H3,(H-,27,28,29,33) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)Cl | |
| AKOS005254043 | 572.632 | C25 H25 F N6 O5 S2 | WNQPRMYOQIYGDX-UHFFFAOYSA-N | InChI=1S/C25H25FN6O5S2/c1-15-3-11-19(12-4-15)39(35,36)28-23-21(30(2)29-37-23)14-31-20(24(34)32(25(31)38)18-9-10-18)13-22(33)27-17-7-5-16(26)6-8-17/h3-8,11-12,18,20H,9-10,13-14H2,1-2H3,(H-,27,28,29,33) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)F | |
| AKOS005254175 | 626.628 | C25 H25 F3 N6 O6 S2 | PSLSEJAZXOQRPW-UHFFFAOYSA-N | InChI=1S/C25H25F3N6O6S2/c1-4-33-23(36)19(13-21(35)29-16-7-9-17(10-8-16)39-25(26,27)28)34(24(33)41)14-20-22(40-31-32(20)3)30-42(37,38)18-11-5-15(2)6-12-18/h5-12,19H,4,13-14H2,1-3H3,(H-,29,30,31,35) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)OC(F)(F)F | |
| AKOS005254039 | 680.538 | C25 H25 I N6 O5 S2 | VHWJJEPGYWIJBF-UHFFFAOYSA-N | InChI=1S/C25H25IN6O5S2/c1-15-3-11-19(12-4-15)39(35,36)28-23-21(30(2)29-37-23)14-31-20(24(34)32(25(31)38)18-9-10-18)13-22(33)27-17-7-5-16(26)6-8-17/h3-8,11-12,18,20H,9-10,13-14H2,1-2H3,(H-,27,28,29,33) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)I | |
| AKOS005252804 | 475.563 | C25 H25 N5 O3 S | UIMLJRVDRFVVDQ-KGENOOAVSA-N | InChI=1S/C25H25N5O3S/c1-4-29-15-23(33-28-29)27-22(31)16-34-25-26-21(14-18-10-12-19(13-11-18)17(2)3)24(32)30(25)20-8-6-5-7-9-20/h5-15,17H,4,16H2,1-3H3/b21-14+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)C(C)C)/C(=O)N2c4ccccc4 | |
| AKOS005250900 | 459.497 | C25 H25 N5 O4 | DCHGXXZHCFHYSF-OUKQBFOZSA-O | InChI=1S/C25H24N5O4/c1-28-22(25(33)34-27-28)18-21(26-23(31)20-10-6-3-7-11-20)24(32)30-16-14-29(15-17-30)13-12-19-8-4-2-5-9-19/h2-13,18H,14-17H2,1H3/q-1/p+1/b13-12+ | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCN(CC2)/C=C/c3ccccc3)\NC(=O)c4ccccc4 | |
| AKOS005250730 | 491.562 | C25 H25 N5 O4 S | IIOQTJWHNBGTCH-HMMYKYKNSA-N | InChI=1S/C25H25N5O4S/c1-4-29(5-2)18-13-11-17(12-14-18)15-20-23(32)30(19-9-7-6-8-10-19)25(26-20)35-16-21(31)22-24(33)34-27-28(22)3/h6-15H,4-5,16H2,1-3H3/b20-15+ | CCN(CC)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3C)[O-])c4ccccc4 | |
| AKOS005252846 | 491.562 | C25 H25 N5 O4 S | WRDIKVFWPVWAJP-XSFVSMFZSA-N | InChI=1S/C25H25N5O4S/c1-4-33-21-13-9-8-10-18(21)14-20-24(32)30(19-11-6-5-7-12-19)25(26-20)35-16-22(31)27-23-15-29(17(2)3)28-34-23/h5-15,17H,4,16H2,1-3H3/b20-14+ | CCOc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)C(C)C)c4ccccc4 | |
| AKOS005252847 | 491.562 | C25 H25 N5 O4 S | FKTVYPHXRCPBSY-KGENOOAVSA-N | InChI=1S/C25H25N5O4S/c1-4-33-20-12-10-18(11-13-20)14-21-24(32)30(19-8-6-5-7-9-19)25(26-21)35-16-22(31)27-23-15-29(17(2)3)28-34-23/h5-15,17H,4,16H2,1-3H3/b21-14+ | CCOc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)C(C)C)c4ccccc4 | |
| AKOS005253492 | 491.562 | C25 H25 N5 O4 S | KUJYRFLAJZERKP-MDZDMXLPSA-N | InChI=1S/C25H25N5O4S/c1-3-29-23(32)20(30(25(29)35)16-21-24(33)34-27-28(21)2)15-22(31)26-19-13-11-18(12-14-19)10-9-17-7-5-4-6-8-17/h4-14,20H,3,15-16H2,1-2H3,(H-,26,27,31,33)/b10-9+ | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[O-])CC(=O)Nc3ccc(cc3)/C=C/c4ccccc4 | |
| AKOS005250963 | 475.496 | C25 H25 N5 O5 | YFJDKKINMHXEOD-UHFFFAOYSA-O | InChI=1S/C25H24N5O5/c1-17(31)18-8-10-20(11-9-18)29-12-14-30(15-13-29)24(33)21(16-22-25(34)35-27-28(22)2)26-23(32)19-6-4-3-5-7-19/h3-11,16H,12-15H2,1-2H3/q-1/p+1 | CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)/C(=C/c3c(on[n+]3C)[O-])/NC(=O)c4ccccc4 | |
| AKOS005252873 | 507.562 | C25 H25 N5 O5 S | WQUXVDJSNSHFRP-CPNJWEJPSA-N | InChI=1S/C25H25N5O5S/c1-16(2)29-14-22(35-28-29)27-21(31)15-36-25-26-19(24(32)30(25)18-10-6-5-7-11-18)13-17-9-8-12-20(33-3)23(17)34-4/h5-14,16H,15H2,1-4H3/b19-13+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252874 | 507.562 | C25 H25 N5 O5 S | RCYLNNXDLNIQOT-UDWIEESQSA-N | InChI=1S/C25H25N5O5S/c1-16(2)29-14-23(35-28-29)27-22(31)15-36-25-26-20(24(32)30(25)18-8-6-5-7-9-18)12-17-10-11-19(33-3)13-21(17)34-4/h5-14,16H,15H2,1-4H3/b20-12+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252897 | 507.562 | C25 H25 N5 O5 S | PNYVCGOBZALXBM-DEDYPNTBSA-N | InChI=1S/C25H25N5O5S/c1-16(2)29-14-23(35-28-29)27-22(31)15-36-25-26-20(24(32)30(25)18-8-6-5-7-9-18)13-17-12-19(33-3)10-11-21(17)34-4/h5-14,16H,15H2,1-4H3/b20-13+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cc(ccc3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252898 | 507.562 | C25 H25 N5 O5 S | YKZMCUZEVPOBHD-XDHOZWIPSA-N | InChI=1S/C25H25N5O5S/c1-16(2)29-14-23(35-28-29)27-22(31)15-36-25-26-19(24(32)30(25)18-8-6-5-7-9-18)12-17-10-11-20(33-3)21(13-17)34-4/h5-14,16H,15H2,1-4H3/b19-12+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(c(c3)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253350 | 507.562 | C25 H25 N5 O5 S | UESMLISTSYEEKZ-HMMYKYKNSA-N | InChI=1S/C25H25N5O5S/c1-3-34-21-12-8-7-9-18(21)15-20-24(32)30(19-10-5-4-6-11-19)25(26-20)36-17-22(31)27-23-16-29(28-35-23)13-14-33-2/h4-12,15-16H,3,13-14,17H2,1-2H3/b20-15+ | CCOc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)CCOC)c4ccccc4 | |
| AKOS005253351 | 507.562 | C25 H25 N5 O5 S | DHPJQBUFABMECU-RCCKNPSSSA-N | InChI=1S/C25H25N5O5S/c1-3-34-20-11-9-18(10-12-20)15-21-24(32)30(19-7-5-4-6-8-19)25(26-21)36-17-22(31)27-23-16-29(28-35-23)13-14-33-2/h4-12,15-16H,3,13-14,17H2,1-2H3/b21-15+ | CCOc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)CCOC)c4ccccc4 | |
| AKOS005250890 | 491.496 | C25 H25 N5 O6 | JPCOPJIRACJUHS-UHFFFAOYSA-O | InChI=1S/C25H24N5O6/c1-35-19-9-7-18(8-10-19)30-21(25(34)36-28-30)15-20(27-23(32)17-5-3-2-4-6-17)24(33)29-13-11-16(12-14-29)22(26)31/h2-10,15-16H,11-14H2,1H3,(H2,26,31)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCC(CC3)C(=O)N)\NC(=O)c4ccccc4 | |
| AKOS005250891 | 491.496 | C25 H25 N5 O6 | MEXDTUXSHRVBCB-UHFFFAOYSA-O | InChI=1S/C25H24N5O6/c1-35-19-11-9-18(10-12-19)30-21(25(34)36-28-30)14-20(27-23(32)16-6-3-2-4-7-16)24(33)29-13-5-8-17(15-29)22(26)31/h2-4,6-7,9-12,14,17H,5,8,13,15H2,1H3,(H2,26,31)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCCC(C3)C(=O)N)\NC(=O)c4ccccc4 | |
| AKOS005250974 | 491.496 | C25 H25 N5 O6 | MLDYKCFWPULOGR-UHFFFAOYSA-O | InChI=1S/C25H24N5O6/c1-17(31)28-12-14-29(15-13-28)24(33)21(26-23(32)18-6-4-3-5-7-18)16-22-25(34)36-27-30(22)19-8-10-20(35-2)11-9-19/h3-11,16H,12-15H2,1-2H3/q-1/p+1 | CC(=O)N1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2c3ccc(cc3)OC)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251048 | 491.496 | C25 H25 N5 O6 | WTALTUYHYVKENT-UHFFFAOYSA-O | InChI=1S/C25H24N5O6/c1-2-35-25(34)29-15-13-28(14-16-29)23(32)20(26-22(31)18-9-5-3-6-10-18)17-21-24(33)36-27-30(21)19-11-7-4-8-12-19/h3-12,17H,2,13-16H2,1H3/q-1/p+1 | CCOC(=O)N1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251266 | 491.496 | C25 H25 N5 O6 | DGPABUMLZYQMTO-UHFFFAOYSA-N | InChI=1S/C25H25N5O6/c1-15(31)26-16-3-5-18(6-4-16)29-23(32)13-21(24(29)33)28(17-7-8-17)14-22-25(34)36-27-30(22)19-9-11-20(35-2)12-10-19/h3-6,9-12,17,21H,7-8,13-14H2,1-2H3,(H-,26,27,31,34) | CC(=O)Nc1ccc(cc1)N2C(=O)CC(C2=O)N(Cc3c(on[n+]3c4ccc(cc4)OC)[O-])C5CC5 | |
| AKOS005252814 | 523.561 | C25 H25 N5 O6 S | WCVUOYUMUUTMEP-WOJGMQOQSA-N | InChI=1S/C25H25N5O6S/c1-5-29-14-23(36-28-29)27-22(31)15-37-25-26-18(24(32)30(25)17-9-7-6-8-10-17)11-16-12-20(34-3)21(35-4)13-19(16)33-2/h6-14H,5,15H2,1-4H3/b18-11+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cc(c(cc3OC)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252815 | 523.561 | C25 H25 N5 O6 S | ZSMJDLFYHOMUJG-WOJGMQOQSA-N | InChI=1S/C25H25N5O6S/c1-5-29-14-22(36-28-29)27-21(31)15-37-25-26-18(24(32)30(25)17-9-7-6-8-10-17)11-16-12-19(33-2)23(35-4)20(13-16)34-3/h6-14H,5,15H2,1-4H3/b18-11+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cc(c(c(c3)OC)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253318 | 523.561 | C25 H25 N5 O6 S | UISKPVJDJPLXPW-XMHGGMMESA-N | InChI=1S/C25H25N5O6S/c1-33-13-12-29-15-22(36-28-29)27-21(31)16-37-25-26-19(24(32)30(25)18-9-5-4-6-10-18)14-17-8-7-11-20(34-2)23(17)35-3/h4-11,14-15H,12-13,16H2,1-3H3/b19-14+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc(c3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253319 | 523.561 | C25 H25 N5 O6 S | RMWZVODDRZLEIL-DEDYPNTBSA-N | InChI=1S/C25H25N5O6S/c1-33-12-11-29-15-23(36-28-29)27-22(31)16-37-25-26-20(24(32)30(25)18-7-5-4-6-8-18)13-17-9-10-19(34-2)14-21(17)35-3/h4-10,13-15H,11-12,16H2,1-3H3/b20-13+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253327 | 523.561 | C25 H25 N5 O6 S | JQHNAIDNKIXRPV-XSFVSMFZSA-N | InChI=1S/C25H25N5O6S/c1-33-12-11-29-15-23(36-28-29)27-22(31)16-37-25-26-20(24(32)30(25)18-7-5-4-6-8-18)14-17-13-19(34-2)9-10-21(17)35-3/h4-10,13-15H,11-12,16H2,1-3H3/b20-14+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cc(ccc3OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253328 | 523.561 | C25 H25 N5 O6 S | UAJKTPPNTHWZIB-CPNJWEJPSA-N | InChI=1S/C25H25N5O6S/c1-33-12-11-29-15-23(36-28-29)27-22(31)16-37-25-26-19(24(32)30(25)18-7-5-4-6-8-18)13-17-9-10-20(34-2)21(14-17)35-3/h4-10,13-15H,11-12,16H2,1-3H3/b19-13+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(c(c3)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253829 | 523.561 | C25 H25 N5 O6 S | GMJUEPQCLRQZFT-UHFFFAOYSA-N | InChI=1S/C25H25N5O6S/c1-4-35-23(33)16-7-9-17(10-8-16)26-21(31)13-19-22(32)30(18-11-5-15(2)6-12-18)25(37)29(19)14-20-24(34)36-27-28(20)3/h5-12,19H,4,13-14H2,1-3H3,(H-,26,27,31,33,34) | CCOC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])c4ccc(cc4)C | |
| AKOS005253923 | 523.561 | C25 H25 N5 O6 S | SBSIEILHFFOLNU-UHFFFAOYSA-N | InChI=1S/C25H25N5O6S/c1-4-35-19-11-9-18(10-12-19)30-23(33)20(29(25(30)37)14-21-24(34)36-27-28(21)3)13-22(32)26-17-7-5-16(6-8-17)15(2)31/h5-12,20H,4,13-14H2,1-3H3,(H-,26,27,31,32,34) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)C(=O)C | |
| AKOS005253930 | 539.56 | C25 H25 N5 O7 S | DRDKTCHBQIIIEF-UHFFFAOYSA-N | InChI=1S/C25H25N5O7S/c1-4-36-18-11-9-17(10-12-18)30-22(32)19(29(25(30)38)14-20-24(34)37-27-28(20)2)13-21(31)26-16-7-5-15(6-8-16)23(33)35-3/h5-12,19H,4,13-14H2,1-3H3,(H-,26,27,31,33,34) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)C(=O)OC | |
| AKOS005253986 | 535.575 | C25 H25 N7 O5 S | KSXJXQXPBJQARY-UHFFFAOYSA-N | InChI=1S/C25H25N7O5S/c1-3-31-24(36)18(13-20(33)27-17-11-9-15(10-12-17)21(26)34)32(25(31)38)14-19-23(37-29-30(19)2)28-22(35)16-7-5-4-6-8-16/h4-12,18H,3,13-14H2,1-2H3,(H3-,26,27,28,29,33,34,35) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)C(=O)N | |
| AKOS005254082 | 535.575 | C25 H25 N7 O5 S | LRHXFIRWGKVMDL-UHFFFAOYSA-N | InChI=1S/C25H25N7O5S/c1-15(33)26-17-9-11-18(12-10-17)27-21(34)13-19-24(36)30(2)25(38)32(19)14-20-23(37-29-31(20)3)28-22(35)16-7-5-4-6-8-16/h4-12,19,29H,13-14H2,1-3H3,(H,28,35) | CC(=O)Nc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)C | |
| AKOS005254014 | 583.639 | C25 H25 N7 O6 S2 | BPVFBTXXAIHBBZ-UHFFFAOYSA-N | InChI=1S/C25H25N7O6S2/c1-30-20(23(38-29-30)28-22(34)15-5-3-2-4-6-15)14-31-19(24(35)32(25(31)39)17-9-10-17)13-21(33)27-16-7-11-18(12-8-16)40(26,36)37/h2-8,11-12,17,19H,9-10,13-14H2,1H3,(H3-,26,27,28,29,33,34,36,37) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)S(=O)(=O)N | |
| AKOS005254134 | 599.639 | C25 H25 N7 O7 S2 | QGGPNPNIFGRRED-UHFFFAOYSA-N | InChI=1S/C25H25N7O7S2/c1-15-3-11-19(12-4-15)41(37,38)27-23-21(29(2)28-39-23)14-30-20(24(34)31(25(30)40)17-9-10-17)13-22(33)26-16-5-7-18(8-6-16)32(35)36/h3-8,11-12,17,20H,9-10,13-14H2,1-2H3,(H-,26,27,28,33) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)N(=O)=O | |
| AKOS005253744 | 462.564 | C25 H26 N4 O3 S | PLMWKTXOIMLZHU-UHFFFAOYSA-N | InChI=1S/C25H26N4O3S/c1-4-25(2,3)15-10-11-18-14(12-15)13-17-19(26)22(33-23(17)27-18)21(30)20-24(31)32-28-29(20)16-8-6-5-7-9-16/h5-9,13,15H,4,10-12H2,1-3H3,(H2-,26,28,30,31) | CCC(C)(C)C1CCc2c(cc3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)C1 | |
| AKOS005250926 | 446.498 | C25 H26 N4 O4 | JXGWPULOQABOLQ-UHFFFAOYSA-O | InChI=1S/C25H25N4O4/c1-28-22(25(32)33-27-28)17-21(26-23(30)20-10-6-3-7-11-20)24(31)29-14-12-19(13-15-29)16-18-8-4-2-5-9-18/h2-11,17,19H,12-16H2,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)N2CCC(CC2)Cc3ccccc3)\NC(=O)c4ccccc4 | |
| AKOS005251029 | 446.498 | C25 H26 N4 O4 | URXUGEYYNKGNSI-UHFFFAOYSA-O | InChI=1S/C25H25N4O4/c30-23(18-11-5-3-6-12-18)27-21(24(31)26-19-13-7-1-2-8-14-19)17-22-25(32)33-28-29(22)20-15-9-4-10-16-20/h3-6,9-12,15-17,19H,1-2,7-8,13-14H2,(H,26,31)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NC4CCCCCC4 | |
| AKOS005250474 | 478.563 | C25 H26 N4 O4 S | FVDLVMOWPQFZAU-UHFFFAOYSA-N | InChI=1S/C25H26N4O4S/c1-25(2,3)17-5-10-20-15(12-17)11-16(13-26)23(27-20)34-14-21(30)22-24(31)33-28-29(22)18-6-8-19(32-4)9-7-18/h6-9,11,17H,5,10,12,14H2,1-4H3 | CC(C)(C)C1CCc2c(cc(c(n2)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])C#N)C1 | |
| AKOS005253713 | 478.563 | C25 H26 N4 O4 S | CIBJLDDFXIEVAX-UHFFFAOYSA-N | InChI=1S/C25H26N4O4S/c1-25(2,3)14-5-10-18-13(11-14)12-17-19(26)22(34-23(17)27-18)21(30)20-24(31)33-28-29(20)15-6-8-16(32-4)9-7-15/h6-9,12,14H,5,10-11H2,1-4H3,(H2-,26,28,30,31) | CC(C)(C)C1CCc2c(cc3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N)C1 | |
| AKOS005250899 | 462.498 | C25 H26 N4 O5 | OUPQSBCEDMEFNV-UHFFFAOYSA-O | InChI=1S/C25H25N4O5/c1-17-8-6-7-15-28(17)24(31)21(26-23(30)18-9-4-3-5-10-18)16-22-25(32)34-27-29(22)19-11-13-20(33-2)14-12-19/h3-5,9-14,16-17H,6-8,15H2,1-2H3/q-1/p+1 | CC1CCCCN1C(=O)/C(=C/c2c(on[n+]2c3ccc(cc3)OC)[O-])/NC(=O)c4ccccc4 | |
| AKOS005250906 | 462.498 | C25 H26 N4 O5 | RFKHTDVDLKLVKV-UHFFFAOYSA-O | InChI=1S/C25H25N4O5/c1-17-7-6-14-28(16-17)24(31)21(26-23(30)18-8-4-3-5-9-18)15-22-25(32)34-27-29(22)19-10-12-20(33-2)13-11-19/h3-5,8-13,15,17H,6-7,14,16H2,1-2H3/q-1/p+1 | CC1CCCN(C1)C(=O)/C(=C/c2c(on[n+]2c3ccc(cc3)OC)[O-])/NC(=O)c4ccccc4 | |
| AKOS005250907 | 462.498 | C25 H26 N4 O5 | DKSZADLEAWOWRL-UHFFFAOYSA-O | InChI=1S/C25H25N4O5/c1-17-12-14-28(15-13-17)24(31)21(26-23(30)18-6-4-3-5-7-18)16-22-25(32)34-27-29(22)19-8-10-20(33-2)11-9-19/h3-11,16-17H,12-15H2,1-2H3/q-1/p+1 | CC1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2c3ccc(cc3)OC)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251090 | 462.498 | C25 H26 N4 O5 | VAWHECPLCUUJAE-UHFFFAOYSA-O | InChI=1S/C25H25N4O5/c1-33-20-14-12-19(13-15-20)29-22(25(32)34-28-29)16-21(24(31)26-18-10-6-3-7-11-18)27-23(30)17-8-4-2-5-9-17/h2,4-5,8-9,12-16,18H,3,6-7,10-11H2,1H3,(H,26,31)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NC3CCCCC3)\NC(=O)c4ccccc4 | |
| AKOS005250898 | 478.497 | C25 H26 N4 O6 | JUJOLFODZIQJND-UHFFFAOYSA-O | InChI=1S/C25H25N4O6/c1-16-14-28(15-17(2)34-16)24(31)21(26-23(30)18-7-5-4-6-8-18)13-22-25(32)35-27-29(22)19-9-11-20(33-3)12-10-19/h4-13,16-17H,14-15H2,1-3H3/q-1/p+1 | CC1CN(CC(O1)C)C(=O)/C(=C/c2c(on[n+]2c3ccc(cc3)OC)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251256 | 478.497 | C25 H26 N4 O6 | JWXBCOKRZCAETI-UHFFFAOYSA-N | InChI=1S/C25H26N4O6/c1-3-34-20-12-6-17(7-13-20)28-23(30)14-21(24(28)31)27(16-4-5-16)15-22-25(32)35-26-29(22)18-8-10-19(33-2)11-9-18/h6-13,16,21H,3-5,14-15H2,1-2H3 | CCOc1ccc(cc1)N2C(=O)CC(C2=O)N(Cc3c(on[n+]3c4ccc(cc4)OC)[O-])C5CC5 | |
| AKOS005253626 | 510.496 | C25 H26 N4 O8 | FDUDODLXSJCRIH-UHFFFAOYSA-N | InChI=1S/C25H26N4O8/c1-3-35-24(32)16-4-6-17(7-5-16)26-22(30)14-21-23(31)28(12-13-36-21)15-20-25(33)37-27-29(20)18-8-10-19(34-2)11-9-18/h4-11,21H,3,12-15H2,1-2H3,(H-,26,27,30,32,33) | CCOC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005253161 | 474.578 | C25 H26 N6 O2 S | RYANKCRXFMHKRF-UHFFFAOYSA-N | InChI=1S/C25H26N6O2S/c26-15-21-14-20-13-19(18-7-3-1-4-8-18)9-10-22(20)27-25(21)34-17-23(32)28-24-16-31(29-33-24)30-11-5-2-6-12-30/h1,3-4,7-8,14,16,19H,2,5-6,9-13,17H2 | c1ccc(cc1)C2CCc3c(cc(c(n3)SCC(=O)[N-]c4c[n+](no4)N5CCCCC5)C#N)C2 | |
| AKOS005252424 | 490.577 | C25 H26 N6 O3 S | HCNGEOJAZXPZHO-RCCKNPSSSA-N | InChI=1S/C25H26N6O3S/c1-4-30(5-2)19-13-11-18(12-14-19)15-21-24(33)31(20-9-7-6-8-10-20)25(26-21)35-17-22(32)27-23-16-29(3)28-34-23/h6-16H,4-5,17H2,1-3H3/b21-15+ | CCN(CC)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)C)c4ccccc4 | |
| AKOS005252719 | 490.577 | C25 H26 N6 O3 S | FTSDHDDCWKYANB-KGENOOAVSA-N | InChI=1S/C25H26N6O3S/c1-17(2)19-12-10-18(11-13-19)14-21-24(33)31(20-8-6-5-7-9-20)25(26-21)35-16-22(32)27-23-15-30(28-34-23)29(3)4/h5-15,17H,16H2,1-4H3/b21-14+ | CC(C)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N(C)C)c4ccccc4 | |
| AKOS005252864 | 490.577 | C25 H26 N6 O3 S | YQAGLAZOSSJHFG-KGENOOAVSA-N | InChI=1S/C25H26N6O3S/c1-17(2)30-15-23(34-28-30)27-22(32)16-35-25-26-21(14-18-10-12-19(13-11-18)29(3)4)24(33)31(25)20-8-6-5-7-9-20/h5-15,17H,16H2,1-4H3/b21-14+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)N(C)C)/C(=O)N2c4ccccc4 | |
| AKOS005253335 | 506.577 | C25 H26 N6 O4 S | GGNBZDNJHVWFEM-RCCKNPSSSA-N | InChI=1S/C25H26N6O4S/c1-29(2)19-11-9-18(10-12-19)15-21-24(33)31(20-7-5-4-6-8-20)25(26-21)36-17-22(32)27-23-16-30(28-35-23)13-14-34-3/h4-12,15-16H,13-14,17H2,1-3H3/b21-15+ | CN(C)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)CCOC)c4ccccc4 | |
| AKOS005253961 | 506.577 | C25 H26 N6 O4 S | UPVBEIALPXGGOX-UHFFFAOYSA-N | InChI=1S/C25H26N6O4S/c1-4-30-24(34)19(14-21(32)26-18-12-10-16(2)11-13-18)31(25(30)36)15-20-23(35-28-29(20)3)27-22(33)17-8-6-5-7-9-17/h5-13,19H,4,14-15H2,1-3H3,(H-,26,27,28,32,33) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)C | |
| AKOS005253958 | 522.576 | C25 H26 N6 O5 S | WFURJATWQPSGIS-UHFFFAOYSA-N | InChI=1S/C25H26N6O5S/c1-4-30-24(34)19(14-21(32)26-17-10-12-18(35-3)13-11-17)31(25(30)37)15-20-23(36-28-29(20)2)27-22(33)16-8-6-5-7-9-16/h5-13,19H,4,14-15H2,1-3H3,(H-,26,27,28,32,33) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)OC | |
| AKOS005254080 | 522.576 | C25 H26 N6 O5 S | HBXUSCOZJCCNEJ-UHFFFAOYSA-N | InChI=1S/C25H26N6O5S/c1-4-35-18-12-10-17(11-13-18)26-21(32)14-19-24(34)29(2)25(37)31(19)15-20-23(36-28-30(20)3)27-22(33)16-8-6-5-7-9-16/h5-13,19H,4,14-15H2,1-3H3,(H-,26,27,28,32,33) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)C | |
| AKOS005254158 | 554.641 | C25 H26 N6 O5 S2 | DKVUAYWCVJHWFT-UHFFFAOYSA-N | InChI=1S/C25H26N6O5S2/c1-16-8-12-19(13-9-16)38(34,35)27-23-21(29(2)28-36-23)15-30-20(24(33)31(25(30)37)18-10-11-18)14-22(32)26-17-6-4-3-5-7-17/h3-9,12-13,18,20H,10-11,14-15H2,1-2H3,(H-,26,27,28,32) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccccc5 | |
| AKOS005252727 | 538.576 | C25 H26 N6 O6 S | VHMDKCNOYMZLMV-WOJGMQOQSA-N | InChI=1S/C25H26N6O6S/c1-29(2)30-14-22(37-28-30)27-21(32)15-38-25-26-18(24(33)31(25)17-9-7-6-8-10-17)11-16-12-19(34-3)23(36-5)20(13-16)35-4/h6-14H,15H2,1-5H3/b18-11+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cc(c(c(c3)OC)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252758 | 538.576 | C25 H26 N6 O6 S | QLGBJKGRSNQMFN-WOJGMQOQSA-N | InChI=1S/C25H26N6O6S/c1-29(2)30-14-23(37-28-30)27-22(32)15-38-25-26-18(24(33)31(25)17-9-7-6-8-10-17)11-16-12-20(35-4)21(36-5)13-19(16)34-3/h6-14H,15H2,1-5H3/b18-11+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cc(c(cc3OC)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253811 | 538.576 | C25 H26 N6 O6 S | LUDCOOPZTJKDIQ-UHFFFAOYSA-N | InChI=1S/C25H26N6O6S/c1-4-36-19-11-9-18(10-12-19)31-23(34)20(30(25(31)38)14-21-24(35)37-28-29(21)3)13-22(33)27-17-7-5-16(6-8-17)26-15(2)32/h5-12,20,28,35H,4,13-14H2,1-3H3 | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)NC(=O)C | |
| AKOS005254159 | 570.641 | C25 H26 N6 O6 S2 | QDRJJIUZIXEUSH-UHFFFAOYSA-N | InChI=1S/C25H26N6O6S2/c1-15-5-11-19(12-6-15)39(35,36)27-23-21(30(4)28-37-23)14-31-20(24(34)29(3)25(31)38)13-22(33)26-18-9-7-17(8-10-18)16(2)32/h5-12,20H,13-14H2,1-4H3,(H-,26,27,28,32,33) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)C(=O)C | |
| AKOS005254169 | 586.64 | C25 H26 N6 O7 S2 | AISSTXSQUWBFFG-UHFFFAOYSA-N | InChI=1S/C25H26N6O7S2/c1-15-5-11-18(12-6-15)40(35,36)27-22-20(30(3)28-38-22)14-31-19(23(33)29(2)25(31)39)13-21(32)26-17-9-7-16(8-10-17)24(34)37-4/h5-12,19H,13-14H2,1-4H3,(H-,26,27,28,32,34) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)C(=O)OC | |
| AKOS005253131 | 502.591 | C25 H26 N8 O2 S | SOOCUVUCTWZDIU-UHFFFAOYSA-N | InChI=1S/C25H26N8O2S/c1-16(2)17-6-8-18(9-7-17)23-19(12-26)24(28)30-25(20(23)13-27)36-15-21(34)29-22-14-33(31-35-22)32-10-4-3-5-11-32/h6-9,14,16H,3-5,10-11,15H2,1-2H3,(H2-,28,29,30,31,34) | CC(C)c1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)N)C#N | |
| AKOS005253118 | 550.59 | C25 H26 N8 O5 S | IOJSPKZRGDMVEW-UHFFFAOYSA-N | InChI=1S/C25H26N8O5S/c1-35-18-9-15(10-19(36-2)23(18)37-3)22-16(11-26)24(28)30-25(17(22)12-27)39-14-20(34)29-21-13-33(31-38-21)32-7-5-4-6-8-32/h9-10,13H,4-8,14H2,1-3H3,(H2-,28,29,30,31,34) | COc1cc(cc(c1OC)OC)c2c(c(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)N)C#N | |
| AKOS005250893 | 461.513 | C25 H27 N5 O4 | FLGSHNPFLZCKHR-UHFFFAOYSA-O | InChI=1S/C25H26N5O4/c1-17-9-10-18(2)21(15-17)29-11-13-30(14-12-29)24(32)20(16-22-25(33)34-27-28(22)3)26-23(31)19-7-5-4-6-8-19/h4-10,15-16H,11-14H2,1-3H3/q-1/p+1 | Cc1ccc(c(c1)N2CCN(CC2)C(=O)/C(=C/c3c(on[n+]3C)[O-])/NC(=O)c4ccccc4)C | |
| AKOS005250953 | 461.513 | C25 H27 N5 O4 | FNJLMZYYLMITEH-UHFFFAOYSA-O | InChI=1S/C25H26N5O4/c1-29-22(25(33)34-28-29)16-21(27-23(31)19-10-6-3-7-11-19)24(32)26-20-12-14-30(15-13-20)17-18-8-4-2-5-9-18/h2-11,16,20H,12-15,17H2,1H3,(H,26,32)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=C(/C(=O)NC2CCN(CC2)Cc3ccccc3)\NC(=O)c4ccccc4 | |
| AKOS005250923 | 477.512 | C25 H27 N5 O5 | LMGNNYLTEJWLSI-UHFFFAOYSA-O | InChI=1S/C25H26N5O5/c1-28-13-6-14-29(16-15-28)24(32)21(26-23(31)18-7-4-3-5-8-18)17-22-25(33)35-27-30(22)19-9-11-20(34-2)12-10-19/h3-5,7-12,17H,6,13-16H2,1-2H3/q-1/p+1 | CN1CCCN(CC1)C(=O)/C(=C/c2c(on[n+]2c3ccc(cc3)OC)[O-])/NC(=O)c4ccccc4 | |
| AKOS005250983 | 477.512 | C25 H27 N5 O5 | NGMNENOLUYXLBV-UHFFFAOYSA-O | InChI=1S/C25H26N5O5/c1-3-28-13-15-29(16-14-28)24(32)21(26-23(31)18-7-5-4-6-8-18)17-22-25(33)35-27-30(22)19-9-11-20(34-2)12-10-19/h4-12,17H,3,13-16H2,1-2H3/q-1/p+1 | CCN1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2c3ccc(cc3)OC)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251932 | 541.642 | C25 H27 N5 O5 S2 | RVVCSODDXIGSCP-UHFFFAOYSA-N | InChI=1S/C25H27N5O5S2/c1-5-18(37-22-23(32)35-28-30(22)15-9-7-6-8-10-15)20(31)27-21-17(13-26)16-11-12-29(14-19(16)36-21)24(33)34-25(2,3)4/h6-10,18H,5,11-12,14H2,1-4H3,(H-,27,28,31,32) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)OC(C)(C)C)C#N)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005250972 | 493.512 | C25 H27 N5 O6 | KESXDMIVVYEDFI-UHFFFAOYSA-O | InChI=1S/C25H26N5O6/c1-35-20-9-7-19(8-10-20)30-22(25(34)36-27-30)17-21(26-23(32)18-5-3-2-4-6-18)24(33)29-13-11-28(12-14-29)15-16-31/h2-10,17,31H,11-16H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCN(CC3)CCO)\NC(=O)c4ccccc4 | |
| AKOS005250996 | 493.512 | C25 H27 N5 O6 | LNMLUGRFFDGHGM-UHFFFAOYSA-O | InChI=1S/C25H26N5O6/c1-34-20-9-7-19(8-10-20)30-22(25(33)36-28-30)17-21(27-23(31)18-5-3-2-4-6-18)24(32)26-11-12-29-13-15-35-16-14-29/h2-10,17H,11-16H2,1H3,(H,26,32)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCCN3CCOCC3)\NC(=O)c4ccccc4 | |
| AKOS005253915 | 525.577 | C25 H27 N5 O6 S | ORBJRFNQWIQKLG-UHFFFAOYSA-N | InChI=1S/C25H27N5O6S/c1-4-34-18-10-6-16(7-11-18)26-22(31)14-20-23(32)30(17-8-12-19(13-9-17)35-5-2)25(37)29(20)15-21-24(33)36-27-28(21)3/h6-13,20H,4-5,14-15H2,1-3H3,(H-,26,27,31,33) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[O-])c4ccc(cc4)OCC | |
| AKOS005251715 | 557.642 | C25 H27 N5 O6 S2 | OJEKXUSMJNNJSD-UHFFFAOYSA-N | InChI=1S/C25H27N5O6S2/c1-14(37-22-23(32)36-28-30(22)15-6-8-16(34-5)9-7-15)20(31)27-21-18(12-26)17-10-11-29(13-19(17)38-21)24(33)35-25(2,3)4/h6-9,14H,10-11,13H2,1-5H3,(H-,27,28,31,32) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)OC(C)(C)C)C#N)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252574 | 557.642 | C25 H27 N5 O6 S2 | MKQSHHGGJKBOQN-UHFFFAOYSA-N | InChI=1S/C25H27N5O6S2/c1-25(2,3)35-24(33)29-11-9-17-18(13-26)21(38-19(17)14-29)27-20(31)10-12-37-22-23(32)36-28-30(22)15-5-7-16(34-4)8-6-15/h5-8H,9-12,14H2,1-4H3,(H-,27,28,31,32) | CC(C)(C)OC(=O)N1CCc2c(sc(c2C#N)NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005254115 | 585.655 | C25 H27 N7 O6 S2 | HHMBVFOVXMRFMB-UHFFFAOYSA-O | InChI=1S/C25H26N7O6S2/c1-15-5-11-19(12-6-15)40(36,37)28-23-21(31(4)29-38-23)14-32-20(24(35)30(3)25(32)39)13-22(34)27-18-9-7-17(8-10-18)26-16(2)33/h5-12,20,29H,13-14H2,1-4H3/q-1/p+1 | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)NC(=O)C | |
| AKOS005254124 | 585.655 | C25 H27 N7 O6 S2 | OBVFDCHKIVKLFP-UHFFFAOYSA-N | InChI=1S/C25H27N7O6S2/c1-4-31-24(35)19(13-21(33)27-17-9-7-16(8-10-17)22(26)34)32(25(31)39)14-20-23(38-29-30(20)3)28-40(36,37)18-11-5-15(2)6-12-18/h5-12,19H,4,13-14H2,1-3H3,(H3-,26,27,28,29,33,34) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)C(=O)N | |
| AKOS005254193 | 633.72 | C25 H27 N7 O7 S3 | CMQCFPCDCHGKAH-UHFFFAOYSA-N | InChI=1S/C25H27N7O7S3/c1-15-3-9-19(10-4-15)42(37,38)28-23-21(30(2)29-39-23)14-31-20(24(34)32(25(31)40)17-7-8-17)13-22(33)27-16-5-11-18(12-6-16)41(26,35)36/h3-6,9-12,17,20H,7-8,13-14H2,1-2H3,(H3-,26,27,28,29,33,35,36) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)S(=O)(=O)N | |
| AKOS005254103 | 606.489 | C25 H28 Br N5 O6 S | CQSDCGBEMNVKGU-UHFFFAOYSA-N | InChI=1S/C25H28BrN5O6S/c1-16(2)31-21(24(37-29-31)28-38(34,35)20-10-4-17(3)5-11-20)15-30-12-13-36-22(25(30)33)14-23(32)27-19-8-6-18(26)7-9-19/h4-11,16,22H,12-15H2,1-3H3,(H-,27,28,29,32) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)Br | |
| AKOS005254102 | 562.038 | C25 H28 Cl N5 O6 S | VDHUSVZAJWTSOH-UHFFFAOYSA-N | InChI=1S/C25H28ClN5O6S/c1-16(2)31-21(24(37-29-31)28-38(34,35)20-10-4-17(3)5-11-20)15-30-12-13-36-22(25(30)33)14-23(32)27-19-8-6-18(26)7-9-19/h4-11,16,22H,12-15H2,1-3H3,(H-,27,28,29,32) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)Cl | |
| AKOS005254110 | 545.583 | C25 H28 F N5 O6 S | HHGVOMAIFBJZTK-UHFFFAOYSA-N | InChI=1S/C25H28FN5O6S/c1-16(2)31-21(24(37-29-31)28-38(34,35)20-10-4-17(3)5-11-20)15-30-12-13-36-22(25(30)33)14-23(32)27-19-8-6-18(26)7-9-19/h4-11,16,22H,12-15H2,1-3H3,(H-,27,28,29,32) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)F | |
| AKOS005254104 | 653.489 | C25 H28 I N5 O6 S | KXAVOWJFVJXZLX-UHFFFAOYSA-N | InChI=1S/C25H28IN5O6S/c1-16(2)31-21(24(37-29-31)28-38(34,35)20-10-4-17(3)5-11-20)15-30-12-13-36-22(25(30)33)14-23(32)27-19-8-6-18(26)7-9-19/h4-11,16,22H,12-15H2,1-3H3,(H-,27,28,29,32) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)I | |
| AKOS005251983 | 496.645 | C25 H28 N4 O3 S2 | NGORICRKVWOJBZ-UHFFFAOYSA-N | InChI=1S/C25H28N4O3S2/c1-5-19(34-23-24(31)32-28-29(23)16-9-7-6-8-10-16)21(30)27-22-18(14-26)17-12-11-15(25(2,3)4)13-20(17)33-22/h6-10,15,19H,5,11-13H2,1-4H3,(H-,27,28,30,31) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C(C)(C)C)C#N)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251698 | 512.644 | C25 H28 N4 O4 S2 | WWJLTIDKEMBGFQ-UHFFFAOYSA-N | InChI=1S/C25H28N4O4S2/c1-14(34-23-24(31)33-28-29(23)16-7-9-17(32-5)10-8-16)21(30)27-22-19(13-26)18-11-6-15(25(2,3)4)12-20(18)35-22/h7-10,14-15H,6,11-12H2,1-5H3,(H-,27,28,30,31) | CC(C(=O)Nc1c(c2c(s1)CC(CC2)C(C)(C)C)C#N)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252614 | 512.644 | C25 H28 N4 O4 S2 | SLVSRRVCDRHBGA-UHFFFAOYSA-N | InChI=1S/C25H28N4O4S2/c1-25(2,3)15-5-10-18-19(14-26)22(35-20(18)13-15)27-21(30)11-12-34-23-24(31)33-28-29(23)16-6-8-17(32-4)9-7-16/h6-9,15H,5,10-13H2,1-4H3,(H-,27,28,30,31) | CC(C)(C)C1CCc2c(sc(c2C#N)NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005251612 | 560.642 | C25 H28 N4 O7 S2 | QKPXUVUHOLELKE-UHFFFAOYSA-N | InChI=1S/C25H28N4O7S2/c1-5-34-22(31)19-16-11-12-28(24(33)35-25(2,3)4)13-17(16)38-20(19)26-18(30)14-37-21-23(32)36-27-29(21)15-9-7-6-8-10-15/h6-10H,5,11-14H2,1-4H3,(H-,26,27,30,31,32) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])CN(CC2)C(=O)OC(C)(C)C | |
| AKOS005251674 | 560.642 | C25 H28 N4 O7 S2 | SMNJANUJFAACCC-UHFFFAOYSA-N | InChI=1S/C25H28N4O7S2/c1-14(37-21-23(32)36-27-29(21)15-9-7-6-8-10-15)19(30)26-20-18(22(31)34-5)16-11-12-28(13-17(16)38-20)24(33)35-25(2,3)4/h6-10,14H,11-13H2,1-5H3,(H-,26,27,30,31,32) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)OC(C)(C)C)C(=O)OC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252276 | 560.642 | C25 H28 N4 O7 S2 | RNTFHXIBPKJWPA-UHFFFAOYSA-N | InChI=1S/C25H28N4O7S2/c1-5-18(38-23-25(33)36-27-29(23)15-7-9-16(34-4)10-8-15)21(31)26-22-20(24(32)35-6-2)17-11-12-28(14(3)30)13-19(17)37-22/h7-10,18H,5-6,11-13H2,1-4H3,(H-,26,27,31,32,33) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)C)C(=O)OCC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252579 | 560.642 | C25 H28 N4 O7 S2 | RGFYORFPPZYEDO-UHFFFAOYSA-N | InChI=1S/C25H28N4O7S2/c1-25(2,3)35-24(33)28-12-10-16-17(14-28)38-20(19(16)22(31)34-4)26-18(30)11-13-37-21-23(32)36-27-29(21)15-8-6-5-7-9-15/h5-9H,10-14H2,1-4H3,(H-,26,27,30,31,32) | CC(C)(C)OC(=O)N1CCc2c(sc(c2C(=O)OC)NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005250203 | 544.577 | C25 H28 N4 O8 S | XJLWDBZBMGXPSU-UHFFFAOYSA-N | InChI=1S/C25H28N4O8S/c1-6-35-22(31)18-16-11-12-28(24(33)36-25(2,3)4)13-17(16)38-21(18)26-20(30)19-23(32)37-27-29(19)14-7-9-15(34-5)10-8-14/h7-10H,6,11-13H2,1-5H3,(H-,26,27,30,31,32) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])CN(CC2)C(=O)OC(C)(C)C | |
| AKOS005251514 | 576.642 | C25 H28 N4 O8 S2 | PAQWBTDYBAYKOX-UHFFFAOYSA-N | InChI=1S/C25H28N4O8S2/c1-25(2,3)36-24(33)28-11-10-16-17(12-28)39-20(19(16)22(31)35-5)26-18(30)13-38-21-23(32)37-27-29(21)14-6-8-15(34-4)9-7-14/h6-9H,10-13H2,1-5H3,(H-,26,27,30,31,32) | CC(C)(C)OC(=O)N1CCc2c(sc(c2C(=O)OC)NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005254170 | 556.657 | C25 H28 N6 O5 S2 | SHCGYISYKKCHBD-UHFFFAOYSA-N | InChI=1S/C25H28N6O5S2/c1-5-30-24(33)20(14-22(32)26-18-10-6-16(2)7-11-18)31(25(30)37)15-21-23(36-28-29(21)4)27-38(34,35)19-12-8-17(3)9-13-19/h6-13,20H,5,14-15H2,1-4H3,(H-,26,27,28,32) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)C | |
| AKOS005254126 | 572.656 | C25 H28 N6 O6 S2 | GQHUCQVWNYZPBN-UHFFFAOYSA-N | InChI=1S/C25H28N6O6S2/c1-5-36-18-10-8-17(9-11-18)26-22(32)14-20-24(33)29(3)25(38)31(20)15-21-23(37-28-30(21)4)27-39(34,35)19-12-6-16(2)7-13-19/h6-13,20H,5,14-15H2,1-4H3,(H-,26,27,28,32) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)C | |
| AKOS005254174 | 572.656 | C25 H28 N6 O6 S2 | RIYOVHLFRODHAR-UHFFFAOYSA-N | InChI=1S/C25H28N6O6S2/c1-5-30-24(33)20(14-22(32)26-17-8-10-18(36-4)11-9-17)31(25(30)38)15-21-23(37-28-29(21)3)27-39(34,35)19-12-6-16(2)7-13-19/h6-13,20H,5,14-15H2,1-4H3,(H-,26,27,28,32) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)OC | |
| AKOS005254093 | 572.59 | C25 H28 N6 O8 S | ZNWRHRBOISCXEZ-UHFFFAOYSA-N | InChI=1S/C25H28N6O8S/c1-16(2)30-21(24(39-28-30)27-40(36,37)20-10-4-17(3)5-11-20)15-29-12-13-38-22(25(29)33)14-23(32)26-18-6-8-19(9-7-18)31(34)35/h4-11,16,22H,12-15H2,1-3H3,(H-,26,27,28,32) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)N(=O)=O | |
| AKOS005251605 | 515.645 | C25 H29 N3 O5 S2 | NICRAXWQXPAATM-UHFFFAOYSA-N | InChI=1S/C25H29N3O5S2/c1-5-32-23(30)20-17-12-11-15(25(2,3)4)13-18(17)35-21(20)26-19(29)14-34-22-24(31)33-27-28(22)16-9-7-6-8-10-16/h6-10,15H,5,11-14H2,1-4H3,(H-,26,27,29,30,31) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])CC(CC2)C(C)(C)C | |
| AKOS005251664 | 515.645 | C25 H29 N3 O5 S2 | OLBJCQCZETVHER-UHFFFAOYSA-N | InChI=1S/C25H29N3O5S2/c1-14(34-22-24(31)33-27-28(22)16-9-7-6-8-10-16)20(29)26-21-19(23(30)32-5)17-12-11-15(25(2,3)4)13-18(17)35-21/h6-10,14-15H,11-13H2,1-5H3,(H-,26,27,29,30,31) | CC(C(=O)Nc1c(c2c(s1)CC(CC2)C(C)(C)C)C(=O)OC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251941 | 515.645 | C25 H29 N3 O5 S2 | WNZZJDNYQYRNIW-UHFFFAOYSA-N | InChI=1S/C25H29N3O5S2/c1-3-18(35-23-25(31)33-27-28(23)16-12-8-7-9-13-16)21(29)26-22-20(24(30)32-4-2)17-14-10-5-6-11-15-19(17)34-22/h7-9,12-13,18H,3-6,10-11,14-15H2,1-2H3,(H-,26,27,29,30,31) | CCC(C(=O)Nc1c(c2c(s1)CCCCCC2)C(=O)OCC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252557 | 515.645 | C25 H29 N3 O5 S2 | NPQSFAIZTMWEKM-UHFFFAOYSA-N | InChI=1S/C25H29N3O5S2/c1-25(2,3)15-10-11-17-18(14-15)35-21(20(17)23(30)32-4)26-19(29)12-13-34-22-24(31)33-27-28(22)16-8-6-5-7-9-16/h5-9,15H,10-14H2,1-4H3,(H-,26,27,29,30,31) | CC(C)(C)C1CCc2c(sc(c2C(=O)OC)NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])C1 | |
| AKOS005250156 | 499.579 | C25 H29 N3 O6 S | TXBPGCPXICRLFG-UHFFFAOYSA-N | InChI=1S/C25H29N3O6S/c1-6-33-23(30)19-17-12-7-14(25(2,3)4)13-18(17)35-22(19)26-21(29)20-24(31)34-27-28(20)15-8-10-16(32-5)11-9-15/h8-11,14H,6-7,12-13H2,1-5H3,(H-,26,27,29,30,31) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])CC(CC2)C(C)(C)C | |
| AKOS005251525 | 531.644 | C25 H29 N3 O6 S2 | ZULXKLXNOGCDHO-UHFFFAOYSA-N | InChI=1S/C25H29N3O6S2/c1-25(2,3)14-6-11-17-18(12-14)36-21(20(17)23(30)33-5)26-19(29)13-35-22-24(31)34-27-28(22)15-7-9-16(32-4)10-8-15/h7-10,14H,6,11-13H2,1-5H3,(H-,26,27,29,30,31) | CC(C)(C)C1CCc2c(sc(c2C(=O)OC)NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005251720 | 531.644 | C25 H29 N3 O6 S2 | MUIUIGOQNSISDR-UHFFFAOYSA-N | InChI=1S/C25H29N3O6S2/c1-4-33-24(30)20-18-9-7-5-6-8-10-19(18)36-22(20)26-21(29)15(2)35-23-25(31)34-27-28(23)16-11-13-17(32-3)14-12-16/h11-15H,4-10H2,1-3H3,(H-,26,27,29,30,31) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccc(cc4)OC)[O-])CCCCCC2 | |
| AKOS005252269 | 531.644 | C25 H29 N3 O6 S2 | BNIWMDKIFYLKPP-UHFFFAOYSA-N | InChI=1S/C25H29N3O6S2/c1-4-18(36-23-25(31)34-27-28(23)15-11-13-16(32-3)14-12-15)21(29)26-22-20(24(30)33-5-2)17-9-7-6-8-10-19(17)35-22/h11-14,18H,4-10H2,1-3H3,(H-,26,27,29,30,31) | CCC(C(=O)Nc1c(c2c(s1)CCCCC2)C(=O)OCC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252271 | 531.644 | C25 H29 N3 O6 S2 | WOHSOVDCHKCXMW-UHFFFAOYSA-N | InChI=1S/C25H29N3O6S2/c1-5-18(36-23-25(31)34-27-28(23)15-8-10-16(32-4)11-9-15)21(29)26-22-20(24(30)33-6-2)17-12-7-14(3)13-19(17)35-22/h8-11,14,18H,5-7,12-13H2,1-4H3,(H-,26,27,29,30,31) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C)C(=O)OCC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252392 | 531.644 | C25 H29 N3 O6 S2 | XIGVTLWXLXCNEK-UHFFFAOYSA-N | InChI=1S/C25H29N3O6S2/c1-4-18(36-23-25(31)34-27-28(23)15-11-13-16(32-2)14-12-15)21(29)26-22-20(24(30)33-3)17-9-7-5-6-8-10-19(17)35-22/h11-14,18H,4-10H2,1-3H3,(H-,26,27,29,30,31) | CCC(C(=O)Nc1c(c2c(s1)CCCCCC2)C(=O)OC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252572 | 531.644 | C25 H29 N3 O6 S2 | RXFIHURYLHJJTJ-UHFFFAOYSA-N | InChI=1S/C25H29N3O6S2/c1-3-33-24(30)21-18-8-6-4-5-7-9-19(18)36-22(21)26-20(29)14-15-35-23-25(31)34-27-28(23)16-10-12-17(32-2)13-11-16/h10-13H,3-9,14-15H2,1-2H3,(H-,26,27,29,30,31) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])CCCCCC2 | |
| AKOS005254196 | 527.593 | C25 H29 N5 O6 S | HGYYMOWHWFBYAX-UHFFFAOYSA-N | InChI=1S/C25H29N5O6S/c1-17(2)30-21(24(36-28-30)27-37(33,34)20-11-9-18(3)10-12-20)16-29-13-14-35-22(25(29)32)15-23(31)26-19-7-5-4-6-8-19/h4-12,17,22H,13-16H2,1-3H3,(H-,26,27,28,31) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)CN3CCOC(C3=O)CC(=O)Nc4ccccc4 | |
| AKOS005254106 | 606.671 | C25 H30 N6 O8 S2 | BEKMQPANDHUEOK-UHFFFAOYSA-N | InChI=1S/C25H30N6O8S2/c1-16(2)31-21(24(39-29-31)28-41(36,37)20-8-4-17(3)5-9-20)15-30-12-13-38-22(25(30)33)14-23(32)27-18-6-10-19(11-7-18)40(26,34)35/h4-11,16,22H,12-15H2,1-3H3,(H3-,26,27,28,29,32,34,35) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)S(=O)(=O)N | |
| AKOS005250849 | 534.946 | C26 H16 Cl F N4 O4 S | OXVDRCUGNJTQOH-STZFKDTASA-N | InChI=1S/C26H16ClFN4O4S/c27-19-12-7-13-20(28)18(19)14-21-24(34)31(16-8-3-1-4-9-16)26(29-21)37-15-22(33)23-25(35)36-30-32(23)17-10-5-2-6-11-17/h1-14H,15H2/b21-14- | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C\c4c(cccc4Cl)F)/C(=O)N3c5ccccc5 | |
| AKOS005250802 | 551.401 | C26 H16 Cl2 N4 O4 S | LIMHTNUZCUASGA-STZFKDTASA-N | InChI=1S/C26H16Cl2N4O4S/c27-19-12-7-13-20(28)18(19)14-21-24(34)31(16-8-3-1-4-9-16)26(29-21)37-15-22(33)23-25(35)36-30-32(23)17-10-5-2-6-11-17/h1-14H,15H2/b21-14- | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C\c4c(cccc4Cl)Cl)/C(=O)N3c5ccccc5 | |
| AKOS005250835 | 551.401 | C26 H16 Cl2 N4 O4 S | MBZCWHWZRYCEMZ-XSFVSMFZSA-N | InChI=1S/C26H16Cl2N4O4S/c27-19-13-7-8-16(22(19)28)14-20-24(34)31(17-9-3-1-4-10-17)26(29-20)37-15-21(33)23-25(35)36-30-32(23)18-11-5-2-6-12-18/h1-14H,15H2/b20-14+ | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4cccc(c4Cl)Cl)/C(=O)N3c5ccccc5 | |
| AKOS005250851 | 551.401 | C26 H16 Cl2 N4 O4 S | DINVLSMHWYAQSV-FYJGNVAPSA-N | InChI=1S/C26H16Cl2N4O4S/c27-17-12-11-16(20(28)14-17)13-21-24(34)31(18-7-3-1-4-8-18)26(29-21)37-15-22(33)23-25(35)36-30-32(23)19-9-5-2-6-10-19/h1-14H,15H2/b21-13+ | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccc(cc4Cl)Cl)/C(=O)N3c5ccccc5 | |
| AKOS005250670 | 561.407 | C26 H17 Br N4 O4 S | XHRBTJTVNBDYCL-RCCKNPSSSA-N | InChI=1S/C26H17BrN4O4S/c27-18-9-7-8-17(14-18)15-21-24(33)30(19-10-3-1-4-11-19)26(28-21)36-16-22(32)23-25(34)35-29-31(23)20-12-5-2-6-13-20/h1-15H,16H2/b21-15+ | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4cccc(c4)Br)/C(=O)N3c5ccccc5 | |
| AKOS005250671 | 561.407 | C26 H17 Br N4 O4 S | IUDVNHJPCGWUSL-RCCKNPSSSA-N | InChI=1S/C26H17BrN4O4S/c27-18-13-11-17(12-14-18)15-21-24(33)30(19-7-3-1-4-8-19)26(28-21)36-16-22(32)23-25(34)35-29-31(23)20-9-5-2-6-10-20/h1-15H,16H2/b21-15+ | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccc(cc4)Br)/C(=O)N3c5ccccc5 | |
| AKOS005250794 | 516.956 | C26 H17 Cl N4 O4 S | JWBJDWNCKBFRSI-RCCKNPSSSA-N | InChI=1S/C26H17ClN4O4S/c27-18-9-7-8-17(14-18)15-21-24(33)30(19-10-3-1-4-11-19)26(28-21)36-16-22(32)23-25(34)35-29-31(23)20-12-5-2-6-13-20/h1-15H,16H2/b21-15+ | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4cccc(c4)Cl)/C(=O)N3c5ccccc5 | |
| AKOS005250795 | 516.956 | C26 H17 Cl N4 O4 S | IGOWMPDYTGZLKO-RCCKNPSSSA-N | InChI=1S/C26H17ClN4O4S/c27-18-13-11-17(12-14-18)15-21-24(33)30(19-7-3-1-4-8-19)26(28-21)36-16-22(32)23-25(34)35-29-31(23)20-9-5-2-6-10-20/h1-15H,16H2/b21-15+ | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccc(cc4)Cl)/C(=O)N3c5ccccc5 | |
| AKOS005250850 | 516.956 | C26 H17 Cl N4 O4 S | VVSHFBGFEHVBAW-RCCKNPSSSA-N | InChI=1S/C26H17ClN4O4S/c27-20-14-8-7-9-17(20)15-21-24(33)30(18-10-3-1-4-11-18)26(28-21)36-16-22(32)23-25(34)35-29-31(23)19-12-5-2-6-13-19/h1-15H,16H2/b21-15+ | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccccc4Cl)/C(=O)N3c5ccccc5 | |
| AKOS005250764 | 500.501 | C26 H17 F N4 O4 S | BLFHKVPXLXDUND-RCCKNPSSSA-N | InChI=1S/C26H17FN4O4S/c27-20-14-8-7-9-17(20)15-21-24(33)30(18-10-3-1-4-11-18)26(28-21)36-16-22(32)23-25(34)35-29-31(23)19-12-5-2-6-13-19/h1-15H,16H2/b21-15+ | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccccc4F)/C(=O)N3c5ccccc5 | |
| AKOS005250765 | 500.501 | C26 H17 F N4 O4 S | PSEUKNRYLFHVKF-RCCKNPSSSA-N | InChI=1S/C26H17FN4O4S/c27-18-13-11-17(12-14-18)15-21-24(33)30(19-7-3-1-4-8-19)26(28-21)36-16-22(32)23-25(34)35-29-31(23)20-9-5-2-6-10-20/h1-15H,16H2/b21-15+ | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccc(cc4)F)/C(=O)N3c5ccccc5 | |
| AKOS005254183 | 523.523 | C26 H17 N7 O4 S | AIRGXWCMKWSFIL-UHFFFAOYSA-N | InChI=1S/C26H17N7O4S/c1-36-13-7-5-12(6-8-13)33-21(26(35)37-32-33)22(34)23-20(28)19-18(16(11-27)24(29)31-25(19)38-23)15-3-2-4-17-14(15)9-10-30-17/h2-10H,1H3,(H5-,28,29,30,31,32,34,35) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(c(c(nc4s3)N)C#N)c5cccc6c5cc[nH]6)N | |
| AKOS005250672 | 482.511 | C26 H18 N4 O4 S | ANLYXXSULRLEFF-LTGZKZEYSA-N | InChI=1S/C26H18N4O4S/c31-22(23-25(33)34-28-30(23)20-14-8-3-9-15-20)17-35-26-27-21(16-18-10-4-1-5-11-18)24(32)29(26)19-12-6-2-7-13-19/h1-16H,17H2/b21-16+ | c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005253195 | 538.537 | C26 H18 N8 O4 S | JERATHBYZGYBHR-UHFFFAOYSA-N | InChI=1S/C26H18N8O4S/c1-13(23(35)30-15-9-7-14(8-10-15)24-31-18-5-3-4-6-19(18)37-24)39-25-17(12-28)20(16(11-27)22(29)32-25)21-26(36)38-33-34(21)2/h3-10,13H,1-2H3,(H3-,29,30,31,32,33,35,36) | CC(C(=O)Nc1ccc(cc1)c2nc3ccccc3o2)Sc4c(c(c(c(n4)N)C#N)c5c(on[n+]5C)[O-])C#N | |
| AKOS005253703 | 563.422 | C26 H19 Br N4 O4 S | HRYPQPLUTROCNS-UHFFFAOYSA-N | InChI=1S/C26H19BrN4O4S/c1-13-18(12-19(32)15-8-10-16(27)11-9-15)14(2)29-25-20(13)21(28)24(36-25)23(33)22-26(34)35-30-31(22)17-6-4-3-5-7-17/h3-11H,12H2,1-2H3,(H2-,28,30,33,34) | Cc1c(c(nc2c1c(c(s2)C(=O)c3c(on[n+]3c4ccccc4)[O-])N)C)CC(=O)c5ccc(cc5)Br | |
| AKOS005250449 | 497.525 | C26 H19 N5 O4 S | ZLICXVHPFDPDLG-UHFFFAOYSA-N | InChI=1S/C26H19N5O4S/c1-34-20-14-12-19(13-15-20)31-24(25(33)35-30-31)21(32)16-36-26-27-22(17-8-4-2-5-9-17)23(28-29-26)18-10-6-3-7-11-18/h2-15H,16H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3nc(c(nn3)c4ccccc4)c5ccccc5 | |
| AKOS005253269 | 481.46 | C26 H19 N5 O5 | GTGMIKBUFLUIRM-UHFFFAOYSA-N | InChI=1S/C26H19N5O5/c32-23-14-20(27-15-21-26(34)36-29-31(21)18-6-2-1-3-7-18)25(33)30(23)17-12-10-16(11-13-17)24-28-19-8-4-5-9-22(19)35-24/h1-13,20,27H,14-15H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)c5nc6ccccc6o5 | |
| AKOS005250854 | 513.525 | C26 H19 N5 O5 S | SBLYZGMFEMKKNP-RCCKNPSSSA-N | InChI=1S/C26H19N5O5S/c1-35-20-12-10-19(11-13-20)31-23(25(34)36-29-31)22(32)16-37-26-28-21(15-17-7-5-6-14-27-17)24(33)30(26)18-8-3-2-4-9-18/h2-15H,16H2,1H3/b21-15+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccccn4)/C(=O)N3c5ccccc5 | |
| AKOS005250858 | 513.525 | C26 H19 N5 O5 S | BXDXETDHPQYFFD-KGENOOAVSA-N | InChI=1S/C26H19N5O5S/c1-35-20-11-9-19(10-12-20)31-23(25(34)36-29-31)22(32)16-37-26-28-21(14-17-6-5-13-27-15-17)24(33)30(26)18-7-3-2-4-8-18/h2-15H,16H2,1H3/b21-14+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4cccnc4)/C(=O)N3c5ccccc5 | |
| AKOS005250866 | 513.525 | C26 H19 N5 O5 S | LXFWZSAMJULLIP-RCCKNPSSSA-N | InChI=1S/C26H19N5O5S/c1-35-20-9-7-19(8-10-20)31-23(25(34)36-29-31)22(32)16-37-26-28-21(15-17-11-13-27-14-12-17)24(33)30(26)18-5-3-2-4-6-18/h2-15H,16H2,1H3/b21-15+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccncc4)/C(=O)N3c5ccccc5 | |
| AKOS005251074 | 523.367 | C26 H20 Cl2 N4 O4 | BYNRKPHXCCPIGL-UHFFFAOYSA-O | InChI=1S/C26H19Cl2N4O4/c27-19-12-11-17(21(28)15-19)13-14-29-25(34)22(30-24(33)18-7-3-1-4-8-18)16-23-26(35)36-31-32(23)20-9-5-2-6-10-20/h1-12,15-16H,13-14H2,(H,29,34)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCCc4ccc(cc4Cl)Cl | |
| AKOS005250837 | 468.527 | C26 H20 N4 O3 S | ZOYNHIOIKMERJT-UHFFFAOYSA-N | InChI=1S/C26H20N4O3S/c27-15-20-14-19-13-18(17-7-3-1-4-8-17)11-12-22(19)28-25(20)34-16-23(31)24-26(32)33-29-30(24)21-9-5-2-6-10-21/h1-10,14,18H,11-13,16H2 | c1ccc(cc1)C2CCc3c(cc(c(n3)SCC(=O)c4c(on[n+]4c5ccccc5)[O-])C#N)C2 | |
| AKOS005253702 | 468.527 | C26 H20 N4 O3 S | ZTQKKJNIESBBDL-UHFFFAOYSA-N | InChI=1S/C26H20N4O3S/c27-21-19-14-17-13-16(15-7-3-1-4-8-15)11-12-20(17)28-25(19)34-24(21)23(31)22-26(32)33-29-30(22)18-9-5-2-6-10-18/h1-10,14,16H,11-13H2,(H2-,27,29,31,32) | c1ccc(cc1)C2CCc3c(cc4c(c(sc4n3)C(=O)c5c(on[n+]5c6ccccc6)[O-])N)C2 | |
| AKOS005250441 | 484.526 | C26 H20 N4 O4 S | NYNZSTBDFLTFIQ-UHFFFAOYSA-N | InChI=1S/C26H20N4O4S/c1-33-20-14-12-19(13-15-20)30-24(25(32)34-29-30)21(31)16-35-26-27-22(17-8-4-2-5-9-17)23(28-26)18-10-6-3-7-11-18/h2-15H,16H2,1H3,(H-,27,28,29,31,32) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3[nH]c(c(n3)c4ccccc4)c5ccccc5 | |
| AKOS005253772 | 484.526 | C26 H20 N4 O4 S | CWWOMKPWSUWRBV-UHFFFAOYSA-N | InChI=1S/C26H20N4O4S/c1-13-8-7-9-16(12-13)19-18(15(3)31)14(2)28-25-20(19)21(27)24(35-25)23(32)22-26(33)34-29-30(22)17-10-5-4-6-11-17/h4-12H,1-3H3,(H2-,27,29,32,33) | Cc1cccc(c1)c2c3c(c(sc3nc(c2C(=O)C)C)C(=O)c4c(on[n+]4c5ccccc5)[O-])N | |
| AKOS005253700 | 500.526 | C26 H20 N4 O5 S | PXBTYKXJNXXADM-UHFFFAOYSA-N | InChI=1S/C26H20N4O5S/c1-13-18(14(2)31)19(15-7-5-4-6-8-15)20-21(27)24(36-25(20)28-13)23(32)22-26(33)35-29-30(22)16-9-11-17(34-3)12-10-16/h4-12H,1-3H3,(H2-,27,29,32,33) | Cc1c(c(c2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N)c5ccccc5)C(=O)C | |
| AKOS005251072 | 484.46 | C26 H20 N4 O6 | IVDJZQHZGLYDGC-UHFFFAOYSA-O | InChI=1S/C26H19N4O6/c31-24(18-7-3-1-4-8-18)28-20(14-21-26(33)36-29-30(21)19-9-5-2-6-10-19)25(32)27-15-17-11-12-22-23(13-17)35-16-34-22/h1-14H,15-16H2,(H,27,32)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCc4ccc5c(c4)OCO5 | |
| AKOS005250829 | 496.54 | C26 H20 N6 O3 S | OPNFZIABMPSIOT-UHFFFAOYSA-N | InChI=1S/C26H20N6O3S/c1-15(2)16-8-10-17(11-9-16)22-19(12-27)24(29)30-25(20(22)13-28)36-14-21(33)23-26(34)35-31-32(23)18-6-4-3-5-7-18/h3-11,15H,14H2,1-2H3,(H2-,29,30,31,33,34) | CC(C)c1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])N)C#N | |
| AKOS005253704 | 496.54 | C26 H20 N6 O3 S | IGJQNCGQGGJUGW-UHFFFAOYSA-N | InChI=1S/C26H20N6O3S/c1-13(2)14-8-10-15(11-9-14)18-17(12-27)24(29)30-25-19(18)20(28)23(36-25)22(33)21-26(34)35-31-32(21)16-6-4-3-5-7-16/h3-11,13H,1-2H3,(H4-,28,29,30,31,33,34) | CC(C)c1ccc(cc1)c2c(c(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)N)C#N | |
| AKOS005250437 | 512.54 | C26 H20 N6 O4 S | VITNRONGLLYUIM-UHFFFAOYSA-N | InChI=1S/C26H20N6O4S/c1-3-15-4-6-16(7-5-15)22-19(12-27)24(29)30-25(20(22)13-28)37-14-21(33)23-26(34)36-31-32(23)17-8-10-18(35-2)11-9-17/h4-11H,3,14H2,1-2H3,(H2-,29,30,31,33,34) | CCc1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N)C#N | |
| AKOS005250813 | 544.539 | C26 H20 N6 O6 S | VBDJRKRMNNXYQD-UHFFFAOYSA-N | InChI=1S/C26H20N6O6S/c1-35-19-9-14(10-20(36-2)23(19)37-3)21-16(11-27)24(29)30-25(17(21)12-28)39-13-18(33)22-26(34)38-31-32(22)15-7-5-4-6-8-15/h4-10H,13H2,1-3H3,(H2-,29,30,31,33,34) | COc1cc(cc(c1OC)OC)c2c(c(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])N)C#N | |
| AKOS005253804 | 544.539 | C26 H20 N6 O6 S | YSQZDTOWOPAEJT-UHFFFAOYSA-N | InChI=1S/C26H20N6O6S/c1-35-15-9-12(10-16(36-2)22(15)37-3)17-14(11-27)24(29)30-25-18(17)19(28)23(39-25)21(33)20-26(34)38-31-32(20)13-7-5-4-6-8-13/h4-10H,1-3H3,(H4-,28,29,30,31,33,34) | COc1cc(cc(c1OC)OC)c2c(c(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)N)C#N | |
| AKOS005251036 | 488.922 | C26 H21 Cl N4 O4 | XRHCIAJJUPYZIL-UHFFFAOYSA-O | InChI=1S/C26H20ClN4O4/c27-20-11-7-8-18(16-20)14-15-28-25(33)22(29-24(32)19-9-3-1-4-10-19)17-23-26(34)35-30-31(23)21-12-5-2-6-13-21/h1-13,16-17H,14-15H2,(H,28,33)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCCc4cccc(c4)Cl | |
| AKOS005251067 | 488.922 | C26 H21 Cl N4 O4 | SGAOUDPPCNGWSQ-UHFFFAOYSA-O | InChI=1S/C26H20ClN4O4/c27-21-14-8-7-9-18(21)15-16-28-25(33)22(29-24(32)19-10-3-1-4-11-19)17-23-26(34)35-30-31(23)20-12-5-2-6-13-20/h1-14,17H,15-16H2,(H,28,33)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCCc4ccccc4Cl | |
| AKOS005251068 | 488.922 | C26 H21 Cl N4 O4 | DQYJTHLLOPFKGK-UHFFFAOYSA-O | InChI=1S/C26H20ClN4O4/c27-20-13-11-18(12-14-20)15-16-28-25(33)22(29-24(32)19-7-3-1-4-8-19)17-23-26(34)35-30-31(23)21-9-5-2-6-10-21/h1-14,17H,15-16H2,(H,28,33)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCCc4ccc(cc4)Cl | |
| AKOS005250990 | 504.922 | C26 H21 Cl N4 O5 | NUWQWEHAQOPRBB-UHFFFAOYSA-O | InChI=1S/C26H20ClN4O5/c1-35-20-13-11-19(12-14-20)31-23(26(34)36-30-31)15-22(29-24(32)17-7-3-2-4-8-17)25(33)28-16-18-9-5-6-10-21(18)27/h2-15H,16H2,1H3,(H,28,33)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCc3ccccc3Cl)\NC(=O)c4ccccc4 | |
| AKOS005251060 | 472.468 | C26 H21 F N4 O4 | BAFVBDWWSGXTJE-UHFFFAOYSA-O | InChI=1S/C26H20FN4O4/c27-20-13-11-18(12-14-20)15-16-28-25(33)22(29-24(32)19-7-3-1-4-8-19)17-23-26(34)35-30-31(23)21-9-5-2-6-10-21/h1-14,17H,15-16H2,(H,28,33)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCCc4ccc(cc4)F | |
| AKOS005251061 | 472.468 | C26 H21 F N4 O4 | QELQSTJUGACDTP-UHFFFAOYSA-O | InChI=1S/C26H20FN4O4/c27-21-14-8-7-9-18(21)15-16-28-25(33)22(29-24(32)19-10-3-1-4-11-19)17-23-26(34)35-30-31(23)20-12-5-2-6-13-20/h1-14,17H,15-16H2,(H,28,33)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCCc4ccccc4F | |
| AKOS005251092 | 488.467 | C26 H21 F N4 O5 | UHGFDYBAPSEOCX-UHFFFAOYSA-O | InChI=1S/C26H20FN4O5/c1-35-21-13-11-20(12-14-21)31-23(26(34)36-30-31)15-22(29-24(32)18-5-3-2-4-6-18)25(33)28-16-17-7-9-19(27)10-8-17/h2-15H,16H2,1H3,(H,28,33)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCc3ccc(cc3)F)\NC(=O)c4ccccc4 | |
| AKOS005252805 | 483.542 | C26 H21 N5 O3 S | HBTADBOLRAJCMN-PXLXIMEGSA-N | InChI=1S/C26H21N5O3S/c1-2-30-16-24(34-29-30)28-23(32)17-35-26-27-22(25(33)31(26)20-12-4-3-5-13-20)15-19-11-8-10-18-9-6-7-14-21(18)19/h3-16H,2,17H2,1H3/b22-15+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc4c3cccc4)/C(=O)N2c5ccccc5 | |
| AKOS005251762 | 502.608 | C26 H22 N4 O3 S2 | JOSWZEIEMBUTBT-UHFFFAOYSA-N | InChI=1S/C26H22N4O3S2/c1-16(34-25-26(32)33-29-30(25)19-10-6-3-7-11-19)23(31)28-24-21(15-27)20-13-12-18(14-22(20)35-24)17-8-4-2-5-9-17/h2-11,16,18H,12-14H2,1H3,(H-,28,29,31,32) | CC(C(=O)Nc1c(c2c(s1)CC(CC2)c3ccccc3)C#N)Sc4c(on[n+]4c5ccccc5)[O-] | |
| AKOS005252546 | 502.608 | C26 H22 N4 O3 S2 | SSVYXMMOKAQXFI-UHFFFAOYSA-N | InChI=1S/C26H22N4O3S2/c27-16-21-20-12-11-18(17-7-3-1-4-8-17)15-22(20)35-24(21)28-23(31)13-14-34-25-26(32)33-29-30(25)19-9-5-2-6-10-19/h1-10,18H,11-15H2,(H-,28,29,31,32) | c1ccc(cc1)C2CCc3c(sc(c3C#N)NC(=O)CCSc4c(on[n+]4c5ccccc5)[O-])C2 | |
| AKOS005251059 | 454.477 | C26 H22 N4 O4 | NMFBMVYINWVPON-UHFFFAOYSA-O | InChI=1S/C26H21N4O4/c1-18(19-11-5-2-6-12-19)27-25(32)22(28-24(31)20-13-7-3-8-14-20)17-23-26(33)34-29-30(23)21-15-9-4-10-16-21/h2-18H,1H3,(H,27,32)/q-1/p+1 | CC(c1ccccc1)NC(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251065 | 454.477 | C26 H22 N4 O4 | XYFIBXNPMZRZSJ-UHFFFAOYSA-O | InChI=1S/C26H21N4O4/c1-18-12-14-19(15-13-18)17-27-25(32)22(28-24(31)20-8-4-2-5-9-20)16-23-26(33)34-29-30(23)21-10-6-3-7-11-21/h2-16H,17H2,1H3,(H,27,32)/q-1/p+1 | Cc1ccc(cc1)CNC(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251066 | 454.477 | C26 H22 N4 O4 | QHSITLDCWQJGHY-UHFFFAOYSA-O | InChI=1S/C26H21N4O4/c31-24(20-12-6-2-7-13-20)28-22(25(32)27-17-16-19-10-4-1-5-11-19)18-23-26(33)34-29-30(23)21-14-8-3-9-15-21/h1-15,18H,16-17H2,(H,27,32)/q-1/p+1 | c1ccc(cc1)CCNC(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251515 | 518.607 | C26 H22 N4 O4 S2 | ZCHFXGMXIRFRDR-UHFFFAOYSA-N | InChI=1S/C26H22N4O4S2/c1-33-19-10-8-18(9-11-19)30-25(26(32)34-29-30)35-15-23(31)28-24-21(14-27)20-12-7-17(13-22(20)36-24)16-5-3-2-4-6-16/h2-6,8-11,17H,7,12-13,15H2,1H3,(H-,28,29,31,32) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3c(c4c(s3)CC(CC4)c5ccccc5)C#N | |
| AKOS005251101 | 470.477 | C26 H22 N4 O5 | OHHKYPATBABMIK-UHFFFAOYSA-O | InChI=1S/C26H21N4O5/c1-34-21-14-12-20(13-15-21)30-23(26(33)35-29-30)16-22(28-24(31)19-10-6-3-7-11-19)25(32)27-17-18-8-4-2-5-9-18/h2-16H,17H2,1H3,(H,27,32)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCc3ccccc3)\NC(=O)c4ccccc4 | |
| AKOS005251913 | 502.542 | C26 H22 N4 O5 S | MTKQOQJHZOVMJY-UHFFFAOYSA-N | InChI=1S/C26H22N4O5S/c1-3-22(36-25-26(32)35-29-30(25)18-12-14-19(33-2)15-13-18)23(31)27-17-10-8-16(9-11-17)24-28-20-6-4-5-7-21(20)34-24/h4-15,22H,3H2,1-2H3,(H-,27,28,29,31,32) | CCC(C(=O)Nc1ccc(cc1)c2nc3ccccc3o2)Sc4c(on[n+]4c5ccc(cc5)OC)[O-] | |
| AKOS005250704 | 518.541 | C26 H22 N4 O6 S | FYSLWCLEVHXZED-UHFFFAOYSA-N | InChI=1S/C26H22N4O6S/c1-30-23(26(32)36-29-30)20(31)14-37-25-18(13-27)17(12-19(28-25)15-8-6-5-7-9-15)16-10-21(33-2)24(35-4)22(11-16)34-3/h5-12H,14H2,1-4H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cc(c(c(c4)OC)OC)OC)C#N | |
| AKOS005253869 | 518.541 | C26 H22 N4 O6 S | ZJOWHBOQWATKNX-UHFFFAOYSA-N | InChI=1S/C26H22N4O6S/c1-30-21(26(32)36-29-30)22(31)24-20(27)19-15(14-10-17(33-2)23(35-4)18(11-14)34-3)12-16(28-25(19)37-24)13-8-6-5-7-9-13/h5-12H,1-4H3,(H2-,27,29,31,32) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4ccccc4)c5cc(c(c(c5)OC)OC)OC)N | |
| AKOS005252720 | 498.556 | C26 H22 N6 O3 S | JHNJCXDPUKWIQA-PXLXIMEGSA-N | InChI=1S/C26H22N6O3S/c1-30(2)31-16-24(35-29-31)28-23(33)17-36-26-27-22(25(34)32(26)20-12-4-3-5-13-20)15-19-11-8-10-18-9-6-7-14-21(18)19/h3-16H,17H2,1-2H3/b22-15+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc4c3cccc4)/C(=O)N2c5ccccc5 | |
| AKOS005252945 | 498.556 | C26 H22 N6 O3 S | DPIRHKHOTSLNLU-UHFFFAOYSA-N | InChI=1S/C26H22N6O3S/c27-16-22-21(19-7-3-1-4-8-19)15-23(20-9-5-2-6-10-20)28-26(22)36-18-24(33)29-25-17-32(30-35-25)31-11-13-34-14-12-31/h1-10,15,17H,11-14,18H2 | c1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005251295 | 482.491 | C26 H22 N6 O4 | DHZSKZQYSVZIRV-BYYHNAKLSA-N | InChI=1S/C26H22N6O4/c1-30(17-23-26(35)36-29-32(23)21-10-6-3-7-11-21)22-16-24(33)31(25(22)34)20-14-12-19(13-15-20)28-27-18-8-4-2-5-9-18/h2-15,22H,16-17H2,1H3/b28-27+ | CN(Cc1c(on[n+]1c2ccccc2)[O-])C3CC(=O)N(C3=O)c4ccc(cc4)/N=N/c5ccccc5 | |
| AKOS005253990 | 588.558 | C26 H23 F3 N6 O5 S | ASAZRDNHFDWWFQ-UHFFFAOYSA-N | InChI=1S/C26H23F3N6O5S/c1-33-20(23(40-32-33)31-22(37)15-5-3-2-4-6-15)14-34-19(24(38)35(25(34)41)17-9-10-17)13-21(36)30-16-7-11-18(12-8-16)39-26(27,28)29/h2-8,11-12,17,19H,9-10,13-14H2,1H3,(H-,30,31,32,36,37) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)OC(F)(F)F | |
| AKOS005251556 | 521.608 | C26 H23 N3 O5 S2 | YKSRDLGWJXWIPC-UHFFFAOYSA-N | InChI=1S/C26H23N3O5S2/c1-33-25(31)22-19-13-12-17(16-8-4-2-5-9-16)14-20(19)36-23(22)27-21(30)15-35-24-26(32)34-28-29(24)18-10-6-3-7-11-18/h2-11,17H,12-15H2,1H3,(H-,27,28,30,31,32) | COC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])CC(CC2)c5ccccc5 | |
| AKOS005250218 | 505.542 | C26 H23 N3 O6 S | JWLIKFGDTOLGPU-UHFFFAOYSA-N | InChI=1S/C26H23N3O6S/c1-33-18-11-9-17(10-12-18)29-22(26(32)35-28-29)23(30)27-24-21(25(31)34-2)19-13-8-16(14-20(19)36-24)15-6-4-3-5-7-15/h3-7,9-12,16H,8,13-14H2,1-2H3,(H-,27,28,30,31,32) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3c(c4c(s3)CC(CC4)c5ccccc5)C(=O)OC | |
| AKOS005252877 | 469.558 | C26 H23 N5 O2 S | ANYNANAMALKHEV-UHFFFAOYSA-N | InChI=1S/C26H23N5O2S/c1-17(2)31-15-25(33-30-31)29-24(32)16-34-26-22(14-27)21(19-11-9-18(3)10-12-19)13-23(28-26)20-7-5-4-6-8-20/h4-13,15,17H,16H2,1-3H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)C(C)C)c4ccccc4 | |
| AKOS005252493 | 485.558 | C26 H23 N5 O3 S | YQJFKYCBSPVMGB-UHFFFAOYSA-N | InChI=1S/C26H23N5O3S/c1-4-31-15-25(34-30-31)29-24(32)16-35-26-22(14-27)21(18-7-5-17(2)6-8-18)13-23(28-26)19-9-11-20(33-3)12-10-19/h5-13,15H,4,16H2,1-3H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccc(cc3)OC)c4ccc(cc4)C)C#N | |
| AKOS005252893 | 485.558 | C26 H23 N5 O3 S | CEDFJOKDZAYWDA-UHFFFAOYSA-N | InChI=1S/C26H23N5O3S/c1-17(2)31-15-25(34-30-31)29-24(32)16-35-26-22(14-27)21(18-9-11-20(33-3)12-10-18)13-23(28-26)19-7-5-4-6-8-19/h4-13,15,17H,16H2,1-3H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4ccc(cc4)OC)C#N | |
| AKOS005253294 | 485.558 | C26 H23 N5 O3 S | JMZCGLAGYUGTPA-UHFFFAOYSA-N | InChI=1S/C26H23N5O3S/c1-18-8-10-19(11-9-18)21-14-23(20-6-4-3-5-7-20)28-26(22(21)15-27)35-17-24(32)29-25-16-31(30-34-25)12-13-33-2/h3-11,14,16H,12-13,17H2,1-2H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)CCOC)c4ccccc4 | |
| AKOS005251659 | 517.623 | C26 H23 N5 O3 S2 | FCWKTUFBVLOUPN-UHFFFAOYSA-N | InChI=1S/C26H23N5O3S2/c1-17(35-25-26(33)34-29-31(25)19-10-6-3-7-11-19)23(32)28-24-21(14-27)20-12-13-30(16-22(20)36-24)15-18-8-4-2-5-9-18/h2-11,17H,12-13,15-16H2,1H3,(H-,28,29,32,33) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)Cc3ccccc3)C#N)Sc4c(on[n+]4c5ccccc5)[O-] | |
| AKOS005252548 | 517.623 | C26 H23 N5 O3 S2 | ZJEVVRGRJSFKAV-UHFFFAOYSA-N | InChI=1S/C26H23N5O3S2/c27-15-21-20-11-13-30(16-18-7-3-1-4-8-18)17-22(20)36-24(21)28-23(32)12-14-35-25-26(33)34-29-31(25)19-9-5-2-6-10-19/h1-10H,11-14,16-17H2,(H-,28,29,32,33) | c1ccc(cc1)CN2CCc3c(sc(c3C#N)NC(=O)CCSc4c(on[n+]4c5ccccc5)[O-])C2 | |
| AKOS005252464 | 501.557 | C26 H23 N5 O4 S | IPYQPSARJNDSOZ-UHFFFAOYSA-N | InChI=1S/C26H23N5O4S/c1-4-31-15-24(35-30-31)29-23(32)16-36-26-20(14-27)19(13-21(28-26)17-9-6-5-7-10-17)18-11-8-12-22(33-2)25(18)34-3/h5-13,15H,4,16H2,1-3H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cccc(c4OC)OC)C#N | |
| AKOS005252915 | 501.557 | C26 H23 N5 O4 S | RDTIOFBDEFPZHP-UHFFFAOYSA-N | InChI=1S/C26H23N5O4S/c1-4-31-15-25(35-30-31)29-24(32)16-36-26-21(14-27)19(13-22(28-26)17-8-6-5-7-9-17)20-12-18(33-2)10-11-23(20)34-3/h5-13,15H,4,16H2,1-3H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cc(ccc4OC)OC)C#N | |
| AKOS005253298 | 501.557 | C26 H23 N5 O4 S | ZMGBPWDXNVDJOP-UHFFFAOYSA-N | InChI=1S/C26H23N5O4S/c1-33-13-12-31-16-25(35-30-31)29-24(32)17-36-26-22(15-27)21(18-8-10-20(34-2)11-9-18)14-23(28-26)19-6-4-3-5-7-19/h3-11,14,16H,12-13,17H2,1-2H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4ccc(cc4)OC)C#N | |
| AKOS005251522 | 533.622 | C26 H23 N5 O4 S2 | PCKFANQDOIPSID-UHFFFAOYSA-N | InChI=1S/C26H23N5O4S2/c1-34-19-9-7-18(8-10-19)31-25(26(33)35-29-31)36-16-23(32)28-24-21(13-27)20-11-12-30(15-22(20)37-24)14-17-5-3-2-4-6-17/h2-10H,11-12,14-16H2,1H3,(H-,28,29,32,33) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3c(c4c(s3)CN(CC4)Cc5ccccc5)C#N | |
| AKOS005252407 | 517.556 | C26 H23 N5 O5 S | ZEURLGXYPUGOAY-UHFFFAOYSA-N | InChI=1S/C26H23N5O5S/c1-31-14-24(36-30-31)29-23(32)15-37-26-19(13-27)18(12-20(28-26)16-8-6-5-7-9-16)17-10-21(33-2)25(35-4)22(11-17)34-3/h5-12,14H,15H2,1-4H3 | C[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cc(c(c(c4)OC)OC)OC)C#N | |
| AKOS005252280 | 549.621 | C26 H23 N5 O5 S2 | XXWMMQOKRNWPCT-UHFFFAOYSA-N | InChI=1S/C26H23N5O5S2/c1-4-20(37-25-26(34)36-30-31(25)17-10-12-18(35-3)13-11-17)22(32)29-24-19(14-27)15(2)21(38-24)23(33)28-16-8-6-5-7-9-16/h5-13,20H,4H2,1-3H3,(H2-,28,29,30,32,33,34) | CCC(C(=O)Nc1c(c(c(s1)C(=O)Nc2ccccc2)C)C#N)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005251054 | 533.556 | C26 H23 N5 O6 S | NFHIHJYSWZBJMS-UHFFFAOYSA-O | InChI=1S/C26H22N5O6S/c27-38(35,36)21-13-11-18(12-14-21)15-16-28-25(33)22(29-24(32)19-7-3-1-4-8-19)17-23-26(34)37-30-31(23)20-9-5-2-6-10-20/h1-14,17H,15-16H2,(H3,27,28,33,35,36)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCCc4ccc(cc4)S(=O)(=O)N | |
| AKOS005251069 | 497.505 | C26 H23 N7 O4 | CEXCARAEMXNQOS-UHFFFAOYSA-O | InChI=1S/C26H22N7O4/c34-23(19-8-3-1-4-9-19)29-21(18-22-25(36)37-30-33(22)20-10-5-2-6-11-20)24(35)31-14-16-32(17-15-31)26-27-12-7-13-28-26/h1-13,18H,14-17H2/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CCN(CC4)c5ncccn5 | |
| AKOS005250103 | 472.493 | C26 H24 N4 O5 | CILXEMFMBSCLMT-UHFFFAOYSA-N | InChI=1S/C26H24N4O5/c31-24(18-28(19-25(32)33)21-12-6-2-7-13-21)29(16-20-10-4-1-5-11-20)17-23-26(34)35-27-30(23)22-14-8-3-9-15-22/h1-15H,16-19H2,(H-,27,32,33,34) | c1ccc(cc1)CN(Cc2c(on[n+]2c3ccccc3)[O-])C(=O)CN(CC(=O)O)c4ccccc4 | |
| AKOS005251628 | 536.623 | C26 H24 N4 O5 S2 | QJOFRNBYMBEVKV-UHFFFAOYSA-N | InChI=1S/C26H24N4O5S2/c1-34-25(32)22-19-12-13-29(14-17-8-4-2-5-9-17)15-20(19)37-23(22)27-21(31)16-36-24-26(33)35-28-30(24)18-10-6-3-7-11-18/h2-11H,12-16H2,1H3,(H-,27,28,31,32,33) | COC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])CN(CC2)Cc5ccccc5 | |
| AKOS005250164 | 520.557 | C26 H24 N4 O6 S | MPQJMIDUTSBIGM-UHFFFAOYSA-N | InChI=1S/C26H24N4O6S/c1-34-18-10-8-17(9-11-18)30-22(26(33)36-28-30)23(31)27-24-21(25(32)35-2)19-12-13-29(15-20(19)37-24)14-16-6-4-3-5-7-16/h3-11H,12-15H2,1-2H3,(H-,27,28,31,32,33) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)Nc3c(c4c(s3)CN(CC4)Cc5ccccc5)C(=O)OC | |
| AKOS005251683 | 552.622 | C26 H24 N4 O6 S2 | CIQSRFLWNIXFDV-UHFFFAOYSA-N | InChI=1S/C26H24N4O6S2/c1-4-35-25(33)19-15(2)20(22(32)27-17-11-7-5-8-12-17)38-23(19)28-21(31)16(3)37-24-26(34)36-29-30(24)18-13-9-6-10-14-18/h5-14,16H,4H2,1-3H3,(H2-,27,28,29,31,32,33,34) | CCOC(=O)c1c(c(sc1NC(=O)C(C)Sc2c(on[n+]2c3ccccc3)[O-])C(=O)Nc4ccccc4)C | |
| AKOS005252399 | 552.622 | C26 H24 N4 O6 S2 | NMVGNMOSRWIZBX-UHFFFAOYSA-N | InChI=1S/C26H24N4O6S2/c1-4-18(37-24-26(34)36-29-30(24)17-13-9-6-10-14-17)21(31)28-23-19(25(33)35-3)15(2)20(38-23)22(32)27-16-11-7-5-8-12-16/h5-14,18H,4H2,1-3H3,(H2-,27,28,29,31,32,33,34) | CCC(C(=O)Nc1c(c(c(s1)C(=O)Nc2ccccc2)C)C(=O)OC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252598 | 552.622 | C26 H24 N4 O6 S2 | PMYMLCJYQOXWLA-UHFFFAOYSA-N | InChI=1S/C26H24N4O6S2/c1-3-35-25(33)20-16(2)21(22(32)27-17-10-6-4-7-11-17)38-23(20)28-19(31)14-15-37-24-26(34)36-29-30(24)18-12-8-5-9-13-18/h4-13H,3,14-15H2,1-2H3,(H2-,27,28,29,31,32,33,34) | CCOC(=O)c1c(c(sc1NC(=O)CCSc2c(on[n+]2c3ccccc3)[O-])C(=O)Nc4ccccc4)C | |
| AKOS005251390 | 568.621 | C26 H24 N4 O7 S2 | BCJZMEFSRLNYFQ-UHFFFAOYSA-N | InChI=1S/C26H24N4O7S2/c1-4-36-25(33)20-15(2)21(22(32)27-16-8-6-5-7-9-16)39-23(20)28-19(31)14-38-24-26(34)37-29-30(24)17-10-12-18(35-3)13-11-17/h5-13H,4,14H2,1-3H3,(H2-,27,28,29,31,32,33,34) | CCOC(=O)c1c(c(sc1NC(=O)CSc2c(on[n+]2c3ccc(cc3)OC)[O-])C(=O)Nc4ccccc4)C | |
| AKOS005251741 | 568.621 | C26 H24 N4 O7 S2 | IFTPPWDKTXAGBX-UHFFFAOYSA-N | InChI=1S/C26H24N4O7S2/c1-14-19(25(33)36-4)23(39-20(14)22(32)27-16-8-6-5-7-9-16)28-21(31)15(2)38-24-26(34)37-29-30(24)17-10-12-18(35-3)13-11-17/h5-13,15H,1-4H3,(H2-,27,28,29,31,32,33,34) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)C(C)Sc3c(on[n+]3c4ccc(cc4)OC)[O-])C(=O)OC | |
| AKOS005252601 | 568.621 | C26 H24 N4 O7 S2 | FRNOCJFSYJMAHB-UHFFFAOYSA-N | InChI=1S/C26H24N4O7S2/c1-15-20(25(33)36-3)23(39-21(15)22(32)27-16-7-5-4-6-8-16)28-19(31)13-14-38-24-26(34)37-29-30(24)17-9-11-18(35-2)12-10-17/h4-12H,13-14H2,1-3H3,(H2-,27,28,29,31,32,33,34) | Cc1c(c(sc1C(=O)Nc2ccccc2)NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])C(=O)OC | |
| AKOS005252715 | 500.572 | C26 H24 N6 O3 S | VSHPJTXKMAYQID-UHFFFAOYSA-N | InChI=1S/C26H24N6O3S/c1-17-5-7-18(8-6-17)21-13-23(19-9-11-20(34-4)12-10-19)28-26(22(21)14-27)36-16-24(33)29-25-15-32(30-35-25)31(2)3/h5-13,15H,16H2,1-4H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N(C)C)c4ccc(cc4)OC | |
| AKOS005252700 | 516.572 | C26 H24 N6 O4 S | YWAKAOHPDLQLQZ-UHFFFAOYSA-N | InChI=1S/C26H24N6O4S/c1-31(2)32-15-24(36-30-32)29-23(33)16-37-26-20(14-27)19(13-21(28-26)17-9-6-5-7-10-17)18-11-8-12-22(34-3)25(18)35-4/h5-13,15H,16H2,1-4H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cccc(c4OC)OC)C#N | |
| AKOS005252731 | 516.572 | C26 H24 N6 O4 S | HHWHMYMVCRJLHJ-UHFFFAOYSA-N | InChI=1S/C26H24N6O4S/c1-31(2)32-15-25(36-30-32)29-24(33)16-37-26-21(14-27)19(13-22(28-26)17-8-6-5-7-9-17)20-12-18(34-3)10-11-23(20)35-4/h5-13,15H,16H2,1-4H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cc(ccc4OC)OC)C#N | |
| AKOS005252971 | 516.572 | C26 H24 N6 O4 S | NGJBVAQABRTSKO-QNUVFLEMSA-N | InChI=1S/C26H24N6O4S/c33-23(28-24-18-31(29-36-24)30-14-16-35-17-15-30)19-37-26-27-22(13-7-10-20-8-3-1-4-9-20)25(34)32(26)21-11-5-2-6-12-21/h1-13,18H,14-17,19H2/b10-7+,22-13+ | c1ccc(cc1)/C=C/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005253477 | 548.637 | C26 H24 N6 O4 S2 | XTFDVMKWZUYNAX-UHFFFAOYSA-N | InChI=1S/C26H24N6O4S2/c1-14-3-10-18-21(11-14)38-23(28-18)15-4-6-16(7-5-15)27-22(33)12-19-24(34)32(17-8-9-17)26(37)31(19)13-20-25(35)36-29-30(20)2/h3-7,10-11,17,19H,8-9,12-13H2,1-2H3,(H-,27,28,29,33,35) | Cc1ccc2c(c1)sc(n2)c3ccc(cc3)NC(=O)CC4C(=O)N(C(=S)N4Cc5c(on[n+]5C)[O-])C6CC6 | |
| AKOS005253073 | 532.571 | C26 H24 N6 O5 S | FPGSVJBUHPZVKB-DEDYPNTBSA-N | InChI=1S/C26H24N6O5S/c33-23(28-24-15-31(29-37-24)30-11-5-2-6-12-30)16-38-26-27-20(25(34)32(26)19-7-3-1-4-8-19)13-18-9-10-21-22(14-18)36-17-35-21/h1,3-4,7-10,13-15H,2,5-6,11-12,16-17H2/b20-13+ | c1ccc(cc1)N2C(=O)/C(=C\c3ccc4c(c3)OCO4)/N=C2SCC(=O)[N-]c5c[n+](no5)N6CCCCC6 | |
| AKOS005254113 | 638.638 | C26 H25 F3 N6 O6 S2 | ZPWPCZJBUVNJSK-UHFFFAOYSA-N | InChI=1S/C26H25F3N6O6S2/c1-15-3-11-19(12-4-15)43(38,39)31-23-21(33(2)32-41-23)14-34-20(24(37)35(25(34)42)17-7-8-17)13-22(36)30-16-5-9-18(10-6-16)40-26(27,28)29/h3-6,9-12,17,20H,7-8,13-14H2,1-2H3,(H-,30,31,32,36) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)OC(F)(F)F | |
| AKOS005253509 | 503.573 | C26 H25 N5 O4 S | MTYWLPXZXOGHLW-BQYQJAHWSA-N | InChI=1S/C26H25N5O4S/c1-29-22(25(34)35-28-29)16-30-21(24(33)31(26(30)36)20-13-14-20)15-23(32)27-19-11-9-18(10-12-19)8-7-17-5-3-2-4-6-17/h2-12,20-21H,13-16H2,1H3,(H-,27,28,32,34)/b8-7+ | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)C3CC3)CC(=O)Nc4ccc(cc4)/C=C/c5ccccc5 | |
| AKOS005254003 | 547.586 | C26 H25 N7 O5 S | FUBYHDZATFIYEM-UHFFFAOYSA-N | InChI=1S/C26H25N7O5S/c1-31-20(24(38-30-31)29-23(36)16-5-3-2-4-6-16)14-32-19(25(37)33(26(32)39)18-11-12-18)13-21(34)28-17-9-7-15(8-10-17)22(27)35/h2-10,18-19H,11-14H2,1H3,(H3-,27,28,29,30,34,35,36) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)C(=O)N | |
| AKOS005251028 | 458.509 | C26 H26 N4 O4 | RRGHPLFHLICWIN-UHFFFAOYSA-O | InChI=1S/C26H25N4O4/c31-24(20-12-6-2-7-13-20)28-22(25(32)27-17-16-19-10-4-1-5-11-19)18-23-26(33)34-29-30(23)21-14-8-3-9-15-21/h2-3,6-10,12-15,18H,1,4-5,11,16-17H2,(H,27,32)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCCC4=CCCCC4 | |
| AKOS005251026 | 490.508 | C26 H26 N4 O6 | BDNDRAIAWDGBNJ-UHFFFAOYSA-O | InChI=1S/C26H25N4O6/c1-2-35-25(33)19-12-9-15-29(17-19)24(32)21(27-23(31)18-10-5-3-6-11-18)16-22-26(34)36-28-30(22)20-13-7-4-8-14-20/h3-8,10-11,13-14,16,19H,2,9,12,15,17H2,1H3/q-1/p+1 | CCOC(=O)C1CCCN(C1)C(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251064 | 490.508 | C26 H26 N4 O6 | SBSLEOBSHPZJED-UHFFFAOYSA-O | InChI=1S/C26H25N4O6/c1-2-35-25(33)19-13-15-29(16-14-19)24(32)21(27-23(31)18-9-5-3-6-10-18)17-22-26(34)36-28-30(22)20-11-7-4-8-12-20/h3-12,17,19H,2,13-16H2,1H3/q-1/p+1 | CCOC(=O)C1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251259 | 506.507 | C26 H26 N4 O7 | KSELCVWSHCUXHJ-UHFFFAOYSA-N | InChI=1S/C26H26N4O7/c1-3-36-25(33)16-4-6-18(7-5-16)29-23(31)14-21(24(29)32)28(17-8-9-17)15-22-26(34)37-27-30(22)19-10-12-20(35-2)13-11-19/h4-7,10-13,17,21H,3,8-9,14-15H2,1-2H3 | CCOC(=O)c1ccc(cc1)N2C(=O)CC(C2=O)N(Cc3c(on[n+]3c4ccc(cc4)OC)[O-])C5CC5 | |
| AKOS005253088 | 502.588 | C26 H26 N6 O3 S | QXXWIRCHUMMGLN-CJLVFECKSA-N | InChI=1S/C26H26N6O3S/c1-19-10-6-7-11-20(19)16-22-25(34)32(21-12-4-2-5-13-21)26(27-22)36-18-23(33)28-24-17-31(29-35-24)30-14-8-3-9-15-30/h2,4-7,10-13,16-17H,3,8-9,14-15,18H2,1H3/b22-16+ | Cc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005253094 | 502.588 | C26 H26 N6 O3 S | HGAIYGCSFNDZLE-CJLVFECKSA-N | InChI=1S/C26H26N6O3S/c1-19-9-8-10-20(15-19)16-22-25(34)32(21-11-4-2-5-12-21)26(27-22)36-18-23(33)28-24-17-31(29-35-24)30-13-6-3-7-14-30/h2,4-5,8-12,15-17H,3,6-7,13-14,18H2,1H3/b22-16+ | Cc1cccc(c1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005253095 | 502.588 | C26 H26 N6 O3 S | REEZJXJCNRYZEJ-CJLVFECKSA-N | InChI=1S/C26H26N6O3S/c1-19-10-12-20(13-11-19)16-22-25(34)32(21-8-4-2-5-9-21)26(27-22)36-18-23(33)28-24-17-31(29-35-24)30-14-6-3-7-15-30/h2,4-5,8-13,16-17H,3,6-7,14-15,18H2,1H3/b22-16+ | Cc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005253093 | 518.587 | C26 H26 N6 O4 S | KSPAHZJKWTVMJK-CJLVFECKSA-N | InChI=1S/C26H26N6O4S/c1-35-21-12-10-19(11-13-21)16-22-25(34)32(20-8-4-2-5-9-20)26(27-22)37-18-23(33)28-24-17-31(29-36-24)30-14-6-3-7-15-30/h2,4-5,8-13,16-17H,3,6-7,14-15,18H2,1H3/b22-16+ | COc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005253099 | 518.587 | C26 H26 N6 O4 S | KJUSPFOONUKYFK-LTGZKZEYSA-N | InChI=1S/C26H26N6O4S/c1-35-22-13-7-6-10-19(22)16-21-25(34)32(20-11-4-2-5-12-20)26(27-21)37-18-23(33)28-24-17-31(29-36-24)30-14-8-3-9-15-30/h2,4-7,10-13,16-17H,3,8-9,14-15,18H2,1H3/b21-16+ | COc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005253104 | 518.587 | C26 H26 N6 O4 S | MSYDAWQJNJQFJJ-CJLVFECKSA-N | InChI=1S/C26H26N6O4S/c1-35-21-12-8-9-19(15-21)16-22-25(34)32(20-10-4-2-5-11-20)26(27-22)37-18-23(33)28-24-17-31(29-36-24)30-13-6-3-7-14-30/h2,4-5,8-12,15-17H,3,6-7,13-14,18H2,1H3/b22-16+ | COc1cccc(c1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005253972 | 518.587 | C26 H26 N6 O4 S | DSENXYAKHACAQD-UHFFFAOYSA-N | InChI=1S/C26H26N6O4S/c1-16-8-10-18(11-9-16)27-22(33)14-20-25(35)32(19-12-13-19)26(37)31(20)15-21-24(36-29-30(21)2)28-23(34)17-6-4-3-5-7-17/h3-11,19-20H,12-15H2,1-2H3,(H-,27,28,29,33,34) | Cc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)C5CC5 | |
| AKOS005252995 | 534.587 | C26 H26 N6 O5 S | BWBNQTNQIFALER-LTGZKZEYSA-N | InChI=1S/C26H26N6O5S/c1-2-36-22-11-7-6-8-19(22)16-21-25(34)32(20-9-4-3-5-10-20)26(27-21)38-18-23(33)28-24-17-31(29-37-24)30-12-14-35-15-13-30/h3-11,16-17H,2,12-15,18H2,1H3/b21-16+ | CCOc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005253001 | 534.587 | C26 H26 N6 O5 S | UGRGPUVNWVAXJT-CJLVFECKSA-N | InChI=1S/C26H26N6O5S/c1-2-36-21-10-8-19(9-11-21)16-22-25(34)32(20-6-4-3-5-7-20)26(27-22)38-18-23(33)28-24-17-31(29-37-24)30-12-14-35-15-13-30/h3-11,16-17H,2,12-15,18H2,1H3/b22-16+ | CCOc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005253987 | 534.587 | C26 H26 N6 O5 S | FKDCOYFIDJRVMY-UHFFFAOYSA-N | InChI=1S/C26H26N6O5S/c1-30-21(24(37-29-30)28-23(34)16-6-4-3-5-7-16)15-31-20(25(35)32(26(31)38)18-10-11-18)14-22(33)27-17-8-12-19(36-2)13-9-17/h3-9,12-13,18,20H,10-11,14-15H2,1-2H3,(H-,27,28,29,33,34) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)OC | |
| AKOS005253989 | 534.587 | C26 H26 N6 O5 S | HFWIVHWIWUNKTK-UHFFFAOYSA-N | InChI=1S/C26H26N6O5S/c1-4-31-25(36)20(14-22(34)27-19-12-10-17(11-13-19)16(2)33)32(26(31)38)15-21-24(37-29-30(21)3)28-23(35)18-8-6-5-7-9-18/h5-13,20H,4,14-15H2,1-3H3,(H-,27,28,29,33,34,35) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)C(=O)C | |
| AKOS005252958 | 550.586 | C26 H26 N6 O6 S | LRWILYJOBLELEV-RCCKNPSSSA-N | InChI=1S/C26H26N6O6S/c1-35-20-8-9-22(36-2)18(14-20)15-21-25(34)32(19-6-4-3-5-7-19)26(27-21)39-17-23(33)28-24-16-31(29-38-24)30-10-12-37-13-11-30/h3-9,14-16H,10-13,17H2,1-2H3/b21-15+ | COc1ccc(c(c1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5)OC | |
| AKOS005252965 | 550.586 | C26 H26 N6 O6 S | UVNKQKJXKAVSIR-XSFVSMFZSA-N | InChI=1S/C26H26N6O6S/c1-35-21-9-8-18(15-22(21)36-2)14-20-25(34)32(19-6-4-3-5-7-19)26(27-20)39-17-23(33)28-24-16-31(29-38-24)30-10-12-37-13-11-30/h3-9,14-16H,10-13,17H2,1-2H3/b20-14+ | COc1ccc(cc1OC)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005253012 | 550.586 | C26 H26 N6 O6 S | UWTJKHJVXOBCQK-HMMYKYKNSA-N | InChI=1S/C26H26N6O6S/c1-35-21-10-6-7-18(24(21)36-2)15-20-25(34)32(19-8-4-3-5-9-19)26(27-20)39-17-22(33)28-23-16-31(29-38-23)30-11-13-37-14-12-30/h3-10,15-16H,11-14,17H2,1-2H3/b20-15+ | COc1cccc(c1OC)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005253019 | 550.586 | C26 H26 N6 O6 S | JCCLHYPBKZUDTG-KGENOOAVSA-N | InChI=1S/C26H26N6O6S/c1-35-20-9-8-18(22(15-20)36-2)14-21-25(34)32(19-6-4-3-5-7-19)26(27-21)39-17-23(33)28-24-16-31(29-38-24)30-10-12-37-13-11-30/h3-9,14-16H,10-13,17H2,1-2H3/b21-14+ | COc1ccc(c(c1)OC)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005253993 | 550.586 | C26 H26 N6 O6 S | KJHGMNJSLCMYOA-UHFFFAOYSA-N | InChI=1S/C26H26N6O6S/c1-4-31-24(35)19(14-21(33)27-18-12-10-17(11-13-18)25(36)37-3)32(26(31)39)15-20-23(38-29-30(20)2)28-22(34)16-8-6-5-7-9-16/h5-13,19H,4,14-15H2,1-3H3,(H-,27,28,29,33,34,36) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)C(=O)OC | |
| AKOS005254041 | 550.586 | C26 H26 N6 O6 S | IOXOWOONAUFEDV-UHFFFAOYSA-N | InChI=1S/C26H26N6O6S/c1-4-37-25(36)17-10-12-18(13-11-17)27-21(33)14-19-24(35)30(2)26(39)32(19)15-20-23(38-29-31(20)3)28-22(34)16-8-6-5-7-9-16/h5-13,19H,4,14-15H2,1-3H3,(H-,27,28,29,33,34,36) | CCOC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)C | |
| AKOS005252782 | 489.589 | C26 H27 N5 O3 S | AMXVXYPKMPFXRN-HYARGMPZSA-N | InChI=1S/C26H27N5O3S/c1-17(2)20-12-10-19(11-13-20)14-22-25(33)31(21-8-6-5-7-9-21)26(27-22)35-16-23(32)28-24-15-30(18(3)4)29-34-24/h5-15,17-18H,16H2,1-4H3/b22-14+ | CC(C)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)C(C)C)c4ccccc4 | |
| AKOS005253366 | 505.589 | C26 H27 N5 O4 S | NTOYKAQJCCJDGB-PXLXIMEGSA-N | InChI=1S/C26H27N5O4S/c1-18(2)20-11-9-19(10-12-20)15-22-25(33)31(21-7-5-4-6-8-21)26(27-22)36-17-23(32)28-24-16-30(29-35-24)13-14-34-3/h4-12,15-16,18H,13-14,17H2,1-3H3/b22-15+ | CC(C)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)CCOC)c4ccccc4 | |
| AKOS005252669 | 537.587 | C26 H27 N5 O6 S | CDULNOUMAURFPG-YBFXNURJSA-N | InChI=1S/C26H27N5O6S/c1-16(2)30-14-23(37-29-30)28-22(32)15-38-26-27-19(25(33)31(26)18-9-7-6-8-10-18)11-17-12-20(34-3)24(36-5)21(13-17)35-4/h6-14,16H,15H2,1-5H3/b19-11+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cc(c(c(c3)OC)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005252793 | 537.587 | C26 H27 N5 O6 S | JQLYTHDPOXRPTH-YBFXNURJSA-N | InChI=1S/C26H27N5O6S/c1-16(2)30-14-24(37-29-30)28-23(32)15-38-26-27-19(25(33)31(26)18-9-7-6-8-10-18)11-17-12-21(35-4)22(36-5)13-20(17)34-3/h6-14,16H,15H2,1-5H3/b19-11+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cc(c(cc3OC)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005250984 | 521.522 | C26 H27 N5 O7 | ZUXJVBIPOBSNIS-UHFFFAOYSA-O | InChI=1S/C26H26N5O7/c1-3-37-26(35)30-15-13-29(14-16-30)24(33)21(27-23(32)18-7-5-4-6-8-18)17-22-25(34)38-28-31(22)19-9-11-20(36-2)12-10-19/h4-12,17H,3,13-16H2,1-2H3/q-1/p+1 | CCOC(=O)N1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2c3ccc(cc3)OC)[O-])/NC(=O)c4ccccc4 | |
| AKOS005253338 | 553.587 | C26 H27 N5 O7 S | YHFKYGFIDGORRQ-XDHOZWIPSA-N | InChI=1S/C26H27N5O7S/c1-34-11-10-30-15-24(38-29-30)28-23(32)16-39-26-27-19(25(33)31(26)18-8-6-5-7-9-18)12-17-13-21(36-3)22(37-4)14-20(17)35-2/h5-9,12-15H,10-11,16H2,1-4H3/b19-12+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cc(c(cc3OC)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253345 | 553.587 | C26 H27 N5 O7 S | WEJZOOZKHBPNEK-XDHOZWIPSA-N | InChI=1S/C26H27N5O7S/c1-34-11-10-30-15-23(38-29-30)28-22(32)16-39-26-27-19(25(33)31(26)18-8-6-5-7-9-18)12-17-13-20(35-2)24(37-4)21(14-17)36-3/h5-9,12-15H,10-11,16H2,1-4H3/b19-12+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cc(c(c(c3)OC)OC)OC)/C(=O)N2c4ccccc4 | |
| AKOS005253810 | 553.587 | C26 H27 N5 O7 S | QWBBQCINEJTWFZ-UHFFFAOYSA-N | InChI=1S/C26H27N5O7S/c1-4-36-19-12-10-18(11-13-19)31-23(33)20(30(26(31)39)15-21-25(35)38-28-29(21)3)14-22(32)27-17-8-6-16(7-9-17)24(34)37-5-2/h6-13,20H,4-5,14-15H2,1-3H3,(H-,27,28,32,34,35) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)C(=O)OCC | |
| AKOS005252972 | 533.602 | C26 H27 N7 O4 S | MKQPTWVQZDVHLO-CJLVFECKSA-N | InChI=1S/C26H27N7O4S/c1-30(2)20-10-8-19(9-11-20)16-22-25(35)33(21-6-4-3-5-7-21)26(27-22)38-18-23(34)28-24-17-32(29-37-24)31-12-14-36-15-13-31/h3-11,16-17H,12-15,18H2,1-2H3/b22-16+ | CN(C)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005253999 | 549.601 | C26 H27 N7 O5 S | YUVPCZPKEGWGKI-UHFFFAOYSA-N | InChI=1S/C26H27N7O5S/c1-4-32-25(37)20(14-22(35)28-19-12-10-18(11-13-19)27-16(2)34)33(26(32)39)15-21-24(38-30-31(21)3)29-23(36)17-8-6-5-7-9-17/h5-13,20,30H,4,14-15H2,1-3H3,(H,29,36) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)NC(=O)C | |
| AKOS005254172 | 597.666 | C26 H27 N7 O6 S2 | BYNKAFMKMDOMEN-UHFFFAOYSA-N | InChI=1S/C26H27N7O6S2/c1-15-3-11-19(12-4-15)41(37,38)29-24-21(31(2)30-39-24)14-32-20(25(36)33(26(32)40)18-9-10-18)13-22(34)28-17-7-5-16(6-8-17)23(27)35/h3-8,11-12,18,20H,9-10,13-14H2,1-2H3,(H3-,27,28,29,30,34,35) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)C(=O)N | |
| AKOS005254092 | 611.59 | C26 H28 F3 N5 O7 S | UFRFJVZUGWKODI-UHFFFAOYSA-N | InChI=1S/C26H28F3N5O7S/c1-16(2)34-21(24(41-32-34)31-42(37,38)20-10-4-17(3)5-11-20)15-33-12-13-39-22(25(33)36)14-23(35)30-18-6-8-19(9-7-18)40-26(27,28)29/h4-11,16,22H,12-15H2,1-3H3,(H-,30,31,32,35) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)OC(F)(F)F | |
| AKOS005254184 | 492.59 | C26 H28 N4 O4 S | XZXBOXIUNVUPTP-UHFFFAOYSA-N | InChI=1S/C26H28N4O4S/c1-5-26(2,3)15-6-11-19-14(12-15)13-18-20(27)23(35-24(18)28-19)22(31)21-25(32)34-29-30(21)16-7-9-17(33-4)10-8-16/h7-10,13,15H,5-6,11-12H2,1-4H3,(H2-,27,29,31,32) | CCC(C)(C)C1CCc2c(cc3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N)C1 | |
| AKOS005251098 | 476.524 | C26 H28 N4 O5 | XQGGOHZOFJDHKE-UHFFFAOYSA-O | InChI=1S/C26H27N4O5/c1-34-21-15-13-20(14-16-21)30-23(26(33)35-29-30)17-22(28-24(31)18-9-5-4-6-10-18)25(32)27-19-11-7-2-3-8-12-19/h4-6,9-10,13-17,19H,2-3,7-8,11-12H2,1H3,(H,27,32)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NC3CCCCCC3)\NC(=O)c4ccccc4 | |
| AKOS005252926 | 504.604 | C26 H28 N6 O3 S | MDTZBAPFNCVNSV-CJLVFECKSA-N | InChI=1S/C26H28N6O3S/c1-4-30(5-2)20-14-12-19(13-15-20)16-22-25(34)32(21-10-8-7-9-11-21)26(27-22)36-18-23(33)28-24-17-31(6-3)29-35-24/h7-17H,4-6,18H2,1-3H3/b22-16+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)N(CC)CC)/C(=O)N2c4ccccc4 | |
| AKOS005253963 | 536.603 | C26 H28 N6 O5 S | CQTXTNQCNWAJBY-UHFFFAOYSA-N | InChI=1S/C26H28N6O5S/c1-4-31-25(35)20(15-22(33)27-18-11-13-19(14-12-18)36-5-2)32(26(31)38)16-21-24(37-29-30(21)3)28-23(34)17-9-7-6-8-10-17/h6-14,20H,4-5,15-16H2,1-3H3,(H-,27,28,29,33,34) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)OCC | |
| AKOS005254177 | 568.668 | C26 H28 N6 O5 S2 | IUYUANPHBREFKY-UHFFFAOYSA-N | InChI=1S/C26H28N6O5S2/c1-16-4-8-18(9-5-16)27-23(33)14-21-25(34)32(19-10-11-19)26(38)31(21)15-22-24(37-29-30(22)3)28-39(35,36)20-12-6-17(2)7-13-20/h4-9,12-13,19,21H,10-11,14-15H2,1-3H3,(H-,27,28,29,33) | Cc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)C5CC5 | |
| AKOS005254112 | 584.667 | C26 H28 N6 O6 S2 | IFKGXIWYOPKSNP-UHFFFAOYSA-N | InChI=1S/C26H28N6O6S2/c1-16-4-12-20(13-5-16)40(35,36)28-24-22(30(2)29-38-24)15-31-21(25(34)32(26(31)39)18-8-9-18)14-23(33)27-17-6-10-19(37-3)11-7-17/h4-7,10-13,18,21H,8-9,14-15H2,1-3H3,(H-,27,28,29,33) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)OC | |
| AKOS005254129 | 584.667 | C26 H28 N6 O6 S2 | UJMVKWINTWYDNX-UHFFFAOYSA-N | InChI=1S/C26H28N6O6S2/c1-5-31-25(35)21(14-23(34)27-19-10-8-18(9-11-19)17(3)33)32(26(31)39)15-22-24(38-29-30(22)4)28-40(36,37)20-12-6-16(2)7-13-20/h6-13,21H,5,14-15H2,1-4H3,(H-,27,28,29,33,34) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)C(=O)C | |
| AKOS005254133 | 600.667 | C26 H28 N6 O7 S2 | PVNNDKAQYZQVIP-UHFFFAOYSA-N | InChI=1S/C26H28N6O7S2/c1-5-31-24(34)20(14-22(33)27-18-10-8-17(9-11-18)25(35)38-4)32(26(31)40)15-21-23(39-29-30(21)3)28-41(36,37)19-12-6-16(2)7-13-19/h6-13,20H,5,14-15H2,1-4H3,(H-,27,28,29,33,35) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)C(=O)OC | |
| AKOS005254173 | 600.667 | C26 H28 N6 O7 S2 | LGWWVBWMOSDJDL-UHFFFAOYSA-N | InChI=1S/C26H28N6O7S2/c1-5-38-25(35)17-8-10-18(11-9-17)27-22(33)14-20-24(34)30(3)26(40)32(20)15-21-23(39-29-31(21)4)28-41(36,37)19-12-6-16(2)7-13-19/h6-13,20H,5,14-15H2,1-4H3,(H-,27,28,29,33,35) | CCOC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)C | |
| AKOS005252275 | 571.668 | C26 H29 N5 O6 S2 | KRDUFYCGNXCZSS-UHFFFAOYSA-N | InChI=1S/C26H29N5O6S2/c1-6-19(39-23-24(33)37-29-31(23)15-7-9-16(35-5)10-8-15)21(32)28-22-18(13-27)17-11-12-30(14-20(17)38-22)25(34)36-26(2,3)4/h7-10,19H,6,11-12,14H2,1-5H3,(H-,28,29,32,33) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)OC(C)(C)C)C#N)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252710 | 519.619 | C26 H29 N7 O3 S | IPSLDSZMHOLGMW-CJLVFECKSA-N | InChI=1S/C26H29N7O3S/c1-5-31(6-2)20-14-12-19(13-15-20)16-22-25(35)33(21-10-8-7-9-11-21)26(27-22)37-18-23(34)28-24-17-32(29-36-24)30(3)4/h7-17H,5-6,18H2,1-4H3/b22-16+ | CCN(CC)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N(C)C)c4ccccc4 | |
| AKOS005254155 | 599.682 | C26 H29 N7 O6 S2 | MBQBRKJFFGLSJQ-UHFFFAOYSA-O | InChI=1S/C26H28N7O6S2/c1-5-32-25(36)21(14-23(35)28-19-10-8-18(9-11-19)27-17(3)34)33(26(32)40)15-22-24(39-30-31(22)4)29-41(37,38)20-12-6-16(2)7-13-20/h6-13,21,30H,5,14-15H2,1-4H3/q-1/p+1 | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)NC(=O)C | |
| AKOS005252396 | 526.671 | C26 H30 N4 O4 S2 | OHLGSFGAGVNGFQ-UHFFFAOYSA-N | InChI=1S/C26H30N4O4S2/c1-6-20(36-24-25(32)34-29-30(24)16-8-10-17(33-5)11-9-16)22(31)28-23-19(14-27)18-12-7-15(26(2,3)4)13-21(18)35-23/h8-11,15,20H,6-7,12-13H2,1-5H3,(H-,28,29,31,32) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C(C)(C)C)C#N)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005251675 | 574.669 | C26 H30 N4 O7 S2 | UKDBLABYUINCDI-UHFFFAOYSA-N | InChI=1S/C26H30N4O7S2/c1-6-35-23(32)19-17-12-13-29(25(34)36-26(3,4)5)14-18(17)39-21(19)27-20(31)15(2)38-22-24(33)37-28-30(22)16-10-8-7-9-11-16/h7-11,15H,6,12-14H2,1-5H3,(H-,27,28,31,32,33) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccccc4)[O-])CN(CC2)C(=O)OC(C)(C)C | |
| AKOS005252389 | 574.669 | C26 H30 N4 O7 S2 | CBDJNJYAKXNNAZ-UHFFFAOYSA-N | InChI=1S/C26H30N4O7S2/c1-6-17(39-22-24(33)37-28-30(22)15-10-8-7-9-11-15)20(31)27-21-19(23(32)35-5)16-12-13-29(14-18(16)38-21)25(34)36-26(2,3)4/h7-11,17H,6,12-14H2,1-5H3,(H-,27,28,31,32,33) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)OC(C)(C)C)C(=O)OC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252585 | 574.669 | C26 H30 N4 O7 S2 | XBVWALMBTOXTTG-UHFFFAOYSA-N | InChI=1S/C26H30N4O7S2/c1-5-35-23(32)20-17-11-13-29(25(34)36-26(2,3)4)15-18(17)39-21(20)27-19(31)12-14-38-22-24(33)37-28-30(22)16-9-7-6-8-10-16/h6-10H,5,11-15H2,1-4H3,(H-,27,28,31,32,33) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])CN(CC2)C(=O)OC(C)(C)C | |
| AKOS005251521 | 590.668 | C26 H30 N4 O8 S2 | OIJOWHRWPUHPNL-UHFFFAOYSA-N | InChI=1S/C26H30N4O8S2/c1-6-36-23(32)20-17-11-12-29(25(34)37-26(2,3)4)13-18(17)40-21(20)27-19(31)14-39-22-24(33)38-28-30(22)15-7-9-16(35-5)10-8-15/h7-10H,6,11-14H2,1-5H3,(H-,27,28,31,32,33) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])CN(CC2)C(=O)OC(C)(C)C | |
| AKOS005251728 | 590.668 | C26 H30 N4 O8 S2 | BKGMEGXCLVTIJJ-UHFFFAOYSA-N | InChI=1S/C26H30N4O8S2/c1-14(39-22-24(33)38-28-30(22)15-7-9-16(35-5)10-8-15)20(31)27-21-19(23(32)36-6)17-11-12-29(13-18(17)40-21)25(34)37-26(2,3)4/h7-10,14H,11-13H2,1-6H3,(H-,27,28,31,32,33) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)OC(C)(C)C)C(=O)OC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252587 | 590.668 | C26 H30 N4 O8 S2 | QRPVJMFGUGPVEL-UHFFFAOYSA-N | InChI=1S/C26H30N4O8S2/c1-26(2,3)37-25(34)29-12-10-17-18(14-29)40-21(20(17)23(32)36-5)27-19(31)11-13-39-22-24(33)38-28-30(22)15-6-8-16(35-4)9-7-15/h6-9H,10-14H2,1-5H3,(H-,27,28,31,32,33) | CC(C)(C)OC(=O)N1CCc2c(sc(c2C(=O)OC)NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005254111 | 586.683 | C26 H30 N6 O6 S2 | QRIWILVWFBSDOS-UHFFFAOYSA-N | InChI=1S/C26H30N6O6S2/c1-5-31-25(34)21(15-23(33)27-18-9-11-19(12-10-18)37-6-2)32(26(31)39)16-22-24(38-29-30(22)4)28-40(35,36)20-13-7-17(3)8-14-20/h7-14,21H,5-6,15-16H2,1-4H3,(H-,27,28,29,33) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)OCC | |
| AKOS005254094 | 570.617 | C26 H30 N6 O7 S | NHCMRGZTWOHAOO-UHFFFAOYSA-N | InChI=1S/C26H30N6O7S/c1-16(2)32-21(25(39-30-32)29-40(36,37)20-10-4-17(3)5-11-20)15-31-12-13-38-22(26(31)35)14-23(33)28-19-8-6-18(7-9-19)24(27)34/h4-11,16,22H,12-15H2,1-3H3,(H3-,27,28,29,30,33,34) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)C(=O)N | |
| AKOS005251665 | 529.671 | C26 H31 N3 O5 S2 | DZAXYTFDRBIGCD-UHFFFAOYSA-N | InChI=1S/C26H31N3O5S2/c1-6-33-24(31)20-18-13-12-16(26(3,4)5)14-19(18)36-22(20)27-21(30)15(2)35-23-25(32)34-28-29(23)17-10-8-7-9-11-17/h7-11,15-16H,6,12-14H2,1-5H3,(H-,27,28,30,31,32) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccccc4)[O-])CC(CC2)C(C)(C)C | |
| AKOS005251925 | 529.671 | C26 H31 N3 O5 S2 | FJBFEYQKCNQNFS-UHFFFAOYSA-N | InChI=1S/C26H31N3O5S2/c1-6-18(36-23-25(32)34-28-29(23)16-10-8-7-9-11-16)21(30)27-22-20(24(31)33-5)17-13-12-15(26(2,3)4)14-19(17)35-22/h7-11,15,18H,6,12-14H2,1-5H3,(H-,27,28,30,31,32) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C(C)(C)C)C(=O)OC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005252558 | 529.671 | C26 H31 N3 O5 S2 | GJMNTDFBIVPEJD-UHFFFAOYSA-N | InChI=1S/C26H31N3O5S2/c1-5-33-24(31)21-18-12-11-16(26(2,3)4)15-19(18)36-22(21)27-20(30)13-14-35-23-25(32)34-28-29(23)17-9-7-6-8-10-17/h6-10,16H,5,11-15H2,1-4H3,(H-,27,28,30,31,32) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])CC(CC2)C(C)(C)C | |
| AKOS005251386 | 545.671 | C26 H31 N3 O6 S2 | ZAINONOVJFUFKQ-UHFFFAOYSA-N | InChI=1S/C26H31N3O6S2/c1-6-34-24(31)21-18-12-7-15(26(2,3)4)13-19(18)37-22(21)27-20(30)14-36-23-25(32)35-28-29(23)16-8-10-17(33-5)11-9-16/h8-11,15H,6-7,12-14H2,1-5H3,(H-,27,28,30,31,32) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])CC(CC2)C(C)(C)C | |
| AKOS005251679 | 545.671 | C26 H31 N3 O6 S2 | XXRQKOWPTZSVKL-UHFFFAOYSA-N | InChI=1S/C26H31N3O6S2/c1-14(36-23-25(32)35-28-29(23)16-8-10-17(33-5)11-9-16)21(30)27-22-20(24(31)34-6)18-12-7-15(26(2,3)4)13-19(18)37-22/h8-11,14-15H,7,12-13H2,1-6H3,(H-,27,28,30,31,32) | CC(C(=O)Nc1c(c2c(s1)CC(CC2)C(C)(C)C)C(=O)OC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252393 | 545.671 | C26 H31 N3 O6 S2 | GMTVVEDJWCTBGW-UHFFFAOYSA-N | InChI=1S/C26H31N3O6S2/c1-4-19(37-24-26(32)35-28-29(24)16-12-14-17(33-3)15-13-16)22(30)27-23-21(25(31)34-5-2)18-10-8-6-7-9-11-20(18)36-23/h12-15,19H,4-11H2,1-3H3,(H-,27,28,30,31,32) | CCC(C(=O)Nc1c(c2c(s1)CCCCCC2)C(=O)OCC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252600 | 545.671 | C26 H31 N3 O6 S2 | KBSIBLUDEXNUJV-UHFFFAOYSA-N | InChI=1S/C26H31N3O6S2/c1-26(2,3)15-6-11-18-19(14-15)37-22(21(18)24(31)34-5)27-20(30)12-13-36-23-25(32)35-28-29(23)16-7-9-17(33-4)10-8-16/h7-10,15H,6,11-14H2,1-5H3,(H-,27,28,30,31,32) | CC(C)(C)C1CCc2c(sc(c2C(=O)OC)NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])C1 | |
| AKOS005254203 | 541.619 | C26 H31 N5 O6 S | UJYOAAQQOARPLY-UHFFFAOYSA-N | InChI=1S/C26H31N5O6S/c1-17(2)31-22(25(37-29-31)28-38(34,35)21-11-7-19(4)8-12-21)16-30-13-14-36-23(26(30)33)15-24(32)27-20-9-5-18(3)6-10-20/h5-12,17,23H,13-16H2,1-4H3,(H-,27,28,29,32) | Cc1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3C(C)C)[N-]S(=O)(=O)c4ccc(cc4)C | |
| AKOS005254091 | 557.619 | C26 H31 N5 O7 S | QDNQCHJNYLJGKT-UHFFFAOYSA-N | InChI=1S/C26H31N5O7S/c1-17(2)31-22(25(38-29-31)28-39(34,35)21-11-5-18(3)6-12-21)16-30-13-14-37-23(26(30)33)15-24(32)27-19-7-9-20(36-4)10-8-19/h5-12,17,23H,13-16H2,1-4H3,(H-,27,28,29,32) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)OC | |
| AKOS005253899 | 514.503 | C27 H16 F2 N4 O3 S | RBKHXZNIHUDNKU-UHFFFAOYSA-N | InChI=1S/C27H16F2N4O3S/c1-33-23(27(35)36-32-33)24(34)25-22(30)21-18(16-10-9-14(28)11-19(16)29)12-20(31-26(21)37-25)17-8-4-6-13-5-2-3-7-15(13)17/h2-12H,1H3,(H2-,30,32,34,35) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4cccc5c4cccc5)c6ccc(cc6F)F)N | |
| AKOS005253868 | 496.512 | C27 H17 F N4 O3 S | GYZUVXKIIBEMGB-UHFFFAOYSA-N | InChI=1S/C27H17FN4O3S/c1-32-23(27(34)35-31-32)24(33)25-22(29)21-19(15-8-4-9-16(28)12-15)13-20(30-26(21)36-25)18-11-5-7-14-6-2-3-10-17(14)18/h2-13H,1H3,(H2-,29,31,33,34) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4cccc5c4cccc5)c6cccc(c6)F)N | |
| AKOS005250459 | 564.972 | C27 H18 Cl F N4 O5 S | ZYGXQEKHCSANSQ-HMAPJEAMSA-N | InChI=1S/C27H18ClFN4O5S/c1-37-18-12-10-17(11-13-18)33-24(26(36)38-31-33)23(34)15-39-27-30-22(14-19-20(28)8-5-9-21(19)29)25(35)32(27)16-6-3-2-4-7-16/h2-14H,15H2,1H3/b22-14- | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C\c4c(cccc4Cl)F)/C(=O)N3c5ccccc5 | |
| AKOS005250418 | 581.427 | C27 H18 Cl2 N4 O5 S | DHCGMGCFEJMCIU-KGENOOAVSA-N | InChI=1S/C27H18Cl2N4O5S/c1-37-19-12-10-18(11-13-19)33-24(26(36)38-31-33)22(34)15-39-27-30-21(14-16-6-5-9-20(28)23(16)29)25(35)32(27)17-7-3-2-4-8-17/h2-14H,15H2,1H3/b21-14+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4cccc(c4Cl)Cl)/C(=O)N3c5ccccc5 | |
| AKOS005250447 | 581.427 | C27 H18 Cl2 N4 O5 S | YXINJGKCITYPHV-LPYMAVHISA-N | InChI=1S/C27H18Cl2N4O5S/c1-37-20-11-9-19(10-12-20)33-24(26(36)38-31-33)23(34)15-39-27-30-22(13-16-7-8-17(28)14-21(16)29)25(35)32(27)18-5-3-2-4-6-18/h2-14H,15H2,1H3/b22-13+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccc(cc4Cl)Cl)/C(=O)N3c5ccccc5 | |
| AKOS005250467 | 581.427 | C27 H18 Cl2 N4 O5 S | MVLYHFFHSDXXPD-HMAPJEAMSA-N | InChI=1S/C27H18Cl2N4O5S/c1-37-18-12-10-17(11-13-18)33-24(26(36)38-31-33)23(34)15-39-27-30-22(14-19-20(28)8-5-9-21(19)29)25(35)32(27)16-6-3-2-4-7-16/h2-14H,15H2,1H3/b22-14- | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C\c4c(cccc4Cl)Cl)/C(=O)N3c5ccccc5 | |
| AKOS005253849 | 478.522 | C27 H18 N4 O3 S | AZBCPSNGPIAUNI-UHFFFAOYSA-N | InChI=1S/C27H18N4O3S/c1-31-23(27(33)34-30-31)24(32)25-22(28)21-19(16-8-3-2-4-9-16)14-20(29-26(21)35-25)18-13-7-11-15-10-5-6-12-17(15)18/h2-14H,1H3,(H2-,28,30,32,33) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4cccc5c4cccc5)c6ccccc6)N | |
| AKOS005250760 | 526.52 | C27 H18 N4 O6 S | ZPZPVJDBZJZZHU-DEDYPNTBSA-N | InChI=1S/C27H18N4O6S/c32-21(24-26(34)37-29-31(24)19-9-5-2-6-10-19)15-38-27-28-20(25(33)30(27)18-7-3-1-4-8-18)13-17-11-12-22-23(14-17)36-16-35-22/h1-14H,15-16H2/b20-13+ | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccc5c(c4)OCO5)/C(=O)N3c6ccccc6 | |
| AKOS005250777 | 591.433 | C27 H19 Br N4 O5 S | KILBQUHOIDWSBU-PXLXIMEGSA-N | InChI=1S/C27H19BrN4O5S/c1-36-21-13-11-20(12-14-21)32-24(26(35)37-30-32)23(33)16-38-27-29-22(15-17-7-9-18(28)10-8-17)25(34)31(27)19-5-3-2-4-6-19/h2-15H,16H2,1H3/b22-15+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccc(cc4)Br)/C(=O)N3c5ccccc5 | |
| AKOS005250868 | 591.433 | C27 H19 Br N4 O5 S | SRRUOWOEDQDCGE-PXLXIMEGSA-N | InChI=1S/C27H19BrN4O5S/c1-36-21-12-10-20(11-13-21)32-24(26(35)37-30-32)23(33)16-38-27-29-22(15-17-6-5-7-18(28)14-17)25(34)31(27)19-8-3-2-4-9-19/h2-15H,16H2,1H3/b22-15+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4cccc(c4)Br)/C(=O)N3c5ccccc5 | |
| AKOS005250410 | 546.982 | C27 H19 Cl N4 O5 S | MWTJJBMEQBDQIH-PXLXIMEGSA-N | InChI=1S/C27H19ClN4O5S/c1-36-21-13-11-20(12-14-21)32-24(26(35)37-30-32)23(33)16-38-27-29-22(15-17-7-9-18(28)10-8-17)25(34)31(27)19-5-3-2-4-6-19/h2-15H,16H2,1H3/b22-15+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccc(cc4)Cl)/C(=O)N3c5ccccc5 | |
| AKOS005250466 | 546.982 | C27 H19 Cl N4 O5 S | NWEZVCYGWMOVFJ-PXLXIMEGSA-N | InChI=1S/C27H19ClN4O5S/c1-36-20-13-11-19(12-14-20)32-24(26(35)37-30-32)23(33)16-38-27-29-22(15-17-7-5-6-10-21(17)28)25(34)31(27)18-8-3-2-4-9-18/h2-15H,16H2,1H3/b22-15+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccccc4Cl)/C(=O)N3c5ccccc5 | |
| AKOS005250472 | 546.982 | C27 H19 Cl N4 O5 S | RFLICEMJJCIPCR-PXLXIMEGSA-N | InChI=1S/C27H19ClN4O5S/c1-36-21-12-10-20(11-13-21)32-24(26(35)37-30-32)23(33)16-38-27-29-22(15-17-6-5-7-18(28)14-17)25(34)31(27)19-8-3-2-4-9-19/h2-15H,16H2,1H3/b22-15+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4cccc(c4)Cl)/C(=O)N3c5ccccc5 | |
| AKOS005250774 | 530.527 | C27 H19 F N4 O5 S | FJXSMSPHFUMXSJ-PXLXIMEGSA-N | InChI=1S/C27H19FN4O5S/c1-36-20-13-11-19(12-14-20)32-24(26(35)37-30-32)23(33)16-38-27-29-22(15-17-7-5-6-10-21(17)28)25(34)31(27)18-8-3-2-4-9-18/h2-15H,16H2,1H3/b22-15+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccccc4F)/C(=O)N3c5ccccc5 | |
| AKOS005250853 | 530.527 | C27 H19 F N4 O5 S | REFUSQIMRQUZIV-PXLXIMEGSA-N | InChI=1S/C27H19FN4O5S/c1-36-21-13-11-20(12-14-21)32-24(26(35)37-30-32)23(33)16-38-27-29-22(15-17-7-9-18(28)10-8-17)25(34)31(27)19-5-3-2-4-6-19/h2-15H,16H2,1H3/b22-15+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccc(cc4)F)/C(=O)N3c5ccccc5 | |
| AKOS005250668 | 496.537 | C27 H20 N4 O4 S | FNKKPTUVTMEAAE-CJLVFECKSA-N | InChI=1S/C27H20N4O4S/c1-18-9-8-10-19(15-18)16-22-25(33)30(20-11-4-2-5-12-20)27(28-22)36-17-23(32)24-26(34)35-29-31(24)21-13-6-3-7-14-21/h2-16H,17H2,1H3/b22-16+ | Cc1cccc(c1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005250669 | 496.537 | C27 H20 N4 O4 S | DCGJHRFPKYNZOC-CJLVFECKSA-N | InChI=1S/C27H20N4O4S/c1-18-12-14-19(15-13-18)16-22-25(33)30(20-8-4-2-5-9-20)27(28-22)36-17-23(32)24-26(34)35-29-31(24)21-10-6-3-7-11-21/h2-16H,17H2,1H3/b22-16+ | Cc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005250773 | 496.537 | C27 H20 N4 O4 S | GYPMIIXKKJWONY-CJLVFECKSA-N | InChI=1S/C27H20N4O4S/c1-18-10-8-9-11-19(18)16-22-25(33)30(20-12-4-2-5-13-20)27(28-22)36-17-23(32)24-26(34)35-29-31(24)21-14-6-3-7-15-21/h2-16H,17H2,1H3/b22-16+ | Cc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005250758 | 512.536 | C27 H20 N4 O5 S | CTFZJYJZPNDVQZ-CJLVFECKSA-N | InChI=1S/C27H20N4O5S/c1-35-21-14-12-18(13-15-21)16-22-25(33)30(19-8-4-2-5-9-19)27(28-22)37-17-23(32)24-26(34)36-29-31(24)20-10-6-3-7-11-20/h2-16H,17H2,1H3/b22-16+ | COc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005250763 | 512.536 | C27 H20 N4 O5 S | KLVDBHIBASNTHY-LTGZKZEYSA-N | InChI=1S/C27H20N4O5S/c1-35-23-15-9-8-10-18(23)16-21-25(33)30(19-11-4-2-5-12-19)27(28-21)37-17-22(32)24-26(34)36-29-31(24)20-13-6-3-7-14-20/h2-16H,17H2,1H3/b21-16+ | COc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005250769 | 512.536 | C27 H20 N4 O5 S | LYDMKIZCTJBIHD-CJLVFECKSA-N | InChI=1S/C27H20N4O5S/c1-35-21-14-8-9-18(15-21)16-22-25(33)30(19-10-4-2-5-11-19)27(28-22)37-17-23(32)24-26(34)36-29-31(24)20-12-6-3-7-13-20/h2-16H,17H2,1H3/b22-16+ | COc1cccc(c1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005250778 | 512.536 | C27 H20 N4 O5 S | GXRDVZDOOOTLTB-CJLVFECKSA-N | InChI=1S/C27H20N4O5S/c1-35-21-14-12-20(13-15-21)31-24(26(34)36-29-31)23(32)17-37-27-28-22(16-18-8-4-2-5-9-18)25(33)30(27)19-10-6-3-7-11-19/h2-16H,17H2,1H3/b22-16+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccccc4)/C(=O)N3c5ccccc5 | |
| AKOS005253749 | 593.448 | C27 H21 Br N4 O5 S | ZOAIXZHHOJCZDO-UHFFFAOYSA-N | InChI=1S/C27H21BrN4O5S/c1-13-19(12-20(33)15-4-6-16(28)7-5-15)14(2)30-26-21(13)22(29)25(38-26)24(34)23-27(35)37-31-32(23)17-8-10-18(36-3)11-9-17/h4-11H,12H2,1-3H3,(H2-,29,31,34,35) | Cc1c(c(nc2c1c(c(s2)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N)C)CC(=O)c5ccc(cc5)Br | |
| AKOS005253277 | 511.552 | C27 H21 N5 O4 S | AMDSUOGTZCTJJW-UHFFFAOYSA-N | InChI=1S/C27H21N5O4S/c1-16-7-12-20-23(13-16)37-25(29-20)17-8-10-18(11-9-17)31-24(33)14-21(26(31)34)28-15-22-27(35)36-30-32(22)19-5-3-2-4-6-19/h2-13,21,28H,14-15H2,1H3 | Cc1ccc2c(c1)sc(n2)c3ccc(cc3)N4C(=O)CC(C4=O)NCc5c(on[n+]5c6ccccc6)[O-] | |
| AKOS005251285 | 495.486 | C27 H21 N5 O5 | VRQPVTMTDMJQHQ-UHFFFAOYSA-N | InChI=1S/C27H21N5O5/c1-30(16-22-27(35)37-29-32(22)19-7-3-2-4-8-19)21-15-24(33)31(26(21)34)18-13-11-17(12-14-18)25-28-20-9-5-6-10-23(20)36-25/h2-14,21H,15-16H2,1H3 | CN(Cc1c(on[n+]1c2ccccc2)[O-])C3CC(=O)N(C3=O)c4ccc(cc4)c5nc6ccccc6o5 | |
| AKOS005253178 | 511.486 | C27 H21 N5 O6 | WSDGHBFIJYHMQS-UHFFFAOYSA-N | InChI=1S/C27H21N5O6/c1-36-19-12-10-18(11-13-19)32-22(27(35)38-30-32)15-28-21-14-24(33)31(26(21)34)17-8-6-16(7-9-17)25-29-20-4-2-3-5-23(20)37-25/h2-13,21,28H,14-15H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)c5nc6ccccc6o5 | |
| AKOS005251005 | 553.393 | C27 H22 Cl2 N4 O5 | NFGBVEMLWCRDLU-UHFFFAOYSA-O | InChI=1S/C27H21Cl2N4O5/c1-37-21-11-9-20(10-12-21)33-24(27(36)38-32-33)16-23(31-25(34)18-5-3-2-4-6-18)26(35)30-14-13-17-7-8-19(28)15-22(17)29/h2-12,15-16H,13-14H2,1H3,(H,30,35)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCCc3ccc(cc3Cl)Cl)\NC(=O)c4ccccc4 | |
| AKOS005251027 | 466.488 | C27 H22 N4 O4 | ZYVYLBNSBHWNAO-UHFFFAOYSA-O | InChI=1S/C27H21N4O4/c32-25(20-10-3-1-4-11-20)28-23(26(33)30-16-15-19-9-7-8-12-21(19)18-30)17-24-27(34)35-29-31(24)22-13-5-2-6-14-22/h1-14,17H,15-16,18H2/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CCc5ccccc5C4 | |
| AKOS005253268 | 466.488 | C27 H22 N4 O4 | UZHRZQMGIYAOKI-VAWYXSNFSA-N | InChI=1S/C27H22N4O4/c32-25-17-23(28-18-24-27(34)35-29-31(24)22-9-5-2-6-10-22)26(33)30(25)21-15-13-20(14-16-21)12-11-19-7-3-1-4-8-19/h1-16,23,28H,17-18H2/b12-11+ | c1ccc(cc1)/C=C/c2ccc(cc2)N3C(=O)CC(C3=O)NCc4c(on[n+]4c5ccccc5)[O-] | |
| AKOS005250468 | 498.553 | C27 H22 N4 O4 S | PUNRRINNONJEQP-UHFFFAOYSA-N | InChI=1S/C27H22N4O4S/c1-34-22-10-8-21(9-11-22)31-25(27(33)35-30-31)24(32)16-36-26-20(15-28)14-19-13-18(7-12-23(19)29-26)17-5-3-2-4-6-17/h2-6,8-11,14,18H,7,12-13,16H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(cc4c(n3)CCC(C4)c5ccccc5)C#N | |
| AKOS005253680 | 498.553 | C27 H22 N4 O4 S | IGPQKRVHLKCNHP-UHFFFAOYSA-N | InChI=1S/C27H22N4O4S/c1-4-16-10-12-17(13-11-16)20-19(15(3)32)14(2)29-26-21(20)22(28)25(36-26)24(33)23-27(34)35-30-31(23)18-8-6-5-7-9-18/h5-13H,4H2,1-3H3,(H2-,28,30,33,34) | CCc1ccc(cc1)c2c3c(c(sc3nc(c2C(=O)C)C)C(=O)c4c(on[n+]4c5ccccc5)[O-])N | |
| AKOS005253741 | 498.553 | C27 H22 N4 O4 S | FDFROWOZEMXNPF-UHFFFAOYSA-N | InChI=1S/C27H22N4O4S/c1-34-19-10-8-18(9-11-19)31-23(27(33)35-30-31)24(32)25-22(28)20-14-17-13-16(15-5-3-2-4-6-15)7-12-21(17)29-26(20)36-25/h2-6,8-11,14,16H,7,12-13H2,1H3,(H2-,28,30,32,33) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4cc5c(nc4s3)CCC(C5)c6ccccc6)N | |
| AKOS005254191 | 514.552 | C27 H22 N4 O5 S | YUPYLWUBUGTYCH-UHFFFAOYSA-N | InChI=1S/C27H22N4O5S/c1-13-6-5-7-16(12-13)20-19(15(3)32)14(2)29-26-21(20)22(28)25(37-26)24(33)23-27(34)36-30-31(23)17-8-10-18(35-4)11-9-17/h5-12H,1-4H3,(H2-,28,30,33,34) | Cc1cccc(c1)c2c3c(c(sc3nc(c2C(=O)C)C)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N | |
| AKOS005251085 | 514.486 | C27 H22 N4 O7 | TZCYTCLJLALNAD-UHFFFAOYSA-O | InChI=1S/C27H21N4O7/c1-35-20-10-8-19(9-11-20)31-22(27(34)38-30-31)14-21(29-25(32)18-5-3-2-4-6-18)26(33)28-15-17-7-12-23-24(13-17)37-16-36-23/h2-14H,15-16H2,1H3,(H,28,33)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCc3ccc4c(c3)OCO4)\NC(=O)c5ccccc5 | |
| AKOS005250425 | 526.566 | C27 H22 N6 O4 S | GFZCYXZHAIJUKO-UHFFFAOYSA-N | InChI=1S/C27H22N6O4S/c1-15(2)16-4-6-17(7-5-16)23-20(12-28)25(30)31-26(21(23)13-29)38-14-22(34)24-27(35)37-32-33(24)18-8-10-19(36-3)11-9-18/h4-11,15H,14H2,1-3H3,(H2-,30,31,32,34,35) | CC(C)c1ccc(cc1)c2c(c(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N)C#N | |
| AKOS005254186 | 526.566 | C27 H22 N6 O4 S | SDSOJXOMLAAABE-UHFFFAOYSA-N | InChI=1S/C27H22N6O4S/c1-13(2)14-4-6-15(7-5-14)19-18(12-28)25(30)31-26-20(19)21(29)24(38-26)23(34)22-27(35)37-32-33(22)16-8-10-17(36-3)11-9-16/h4-11,13H,1-3H3,(H4-,29,30,31,32,34,35) | CC(C)c1ccc(cc1)c2c(c(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N)N)C#N | |
| AKOS005250417 | 574.565 | C27 H22 N6 O7 S | PWPSXAMVXDQHEM-UHFFFAOYSA-N | InChI=1S/C27H22N6O7S/c1-36-16-7-5-15(6-8-16)33-23(27(35)40-32-33)19(34)13-41-26-18(12-29)22(17(11-28)25(30)31-26)14-9-20(37-2)24(39-4)21(10-14)38-3/h5-10H,13H2,1-4H3,(H2-,30,31,32,34,35) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(c(c(c(n3)N)C#N)c4cc(c(c(c4)OC)OC)OC)C#N | |
| AKOS005253761 | 574.565 | C27 H22 N6 O7 S | KRLNRYOGIVITLI-UHFFFAOYSA-N | InChI=1S/C27H22N6O7S/c1-36-14-7-5-13(6-8-14)33-21(27(35)40-32-33)22(34)24-20(29)19-18(15(11-28)25(30)31-26(19)41-24)12-9-16(37-2)23(39-4)17(10-12)38-3/h5-10H,1-4H3,(H4-,29,30,31,32,34,35) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(c(c(nc4s3)N)C#N)c5cc(c(c(c5)OC)OC)OC)N | |
| AKOS005250989 | 518.948 | C27 H23 Cl N4 O5 | FWWPSPPJNBRSLW-UHFFFAOYSA-O | InChI=1S/C27H22ClN4O5/c1-36-22-12-10-21(11-13-22)32-24(27(35)37-31-32)17-23(30-25(33)19-7-3-2-4-8-19)26(34)29-15-14-18-6-5-9-20(28)16-18/h2-13,16-17H,14-15H2,1H3,(H,29,34)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCCc3cccc(c3)Cl)\NC(=O)c4ccccc4 | |
| AKOS005251003 | 518.948 | C27 H23 Cl N4 O5 | PWTWORXAVMLOQC-UHFFFAOYSA-O | InChI=1S/C27H22ClN4O5/c1-36-21-13-11-20(12-14-21)32-24(27(35)37-31-32)17-23(30-25(33)19-8-3-2-4-9-19)26(34)29-16-15-18-7-5-6-10-22(18)28/h2-14,17H,15-16H2,1H3,(H,29,34)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCCc3ccccc3Cl)\NC(=O)c4ccccc4 | |
| AKOS005251004 | 518.948 | C27 H23 Cl N4 O5 | JHCSQZLLHJVSOW-UHFFFAOYSA-O | InChI=1S/C27H22ClN4O5/c1-36-22-13-11-21(12-14-22)32-24(27(35)37-31-32)17-23(30-25(33)19-5-3-2-4-6-19)26(34)29-16-15-18-7-9-20(28)10-8-18/h2-14,17H,15-16H2,1H3,(H,29,34)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCCc3ccc(cc3)Cl)\NC(=O)c4ccccc4 | |
| AKOS005251001 | 502.494 | C27 H23 F N4 O5 | DAYNCNYXBSZMRE-UHFFFAOYSA-O | InChI=1S/C27H22FN4O5/c1-36-22-13-11-21(12-14-22)32-24(27(35)37-31-32)17-23(30-25(33)19-5-3-2-4-6-19)26(34)29-16-15-18-7-9-20(28)10-8-18/h2-14,17H,15-16H2,1H3,(H,29,34)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCCc3ccc(cc3)F)\NC(=O)c4ccccc4 | |
| AKOS005251002 | 502.494 | C27 H23 F N4 O5 | IIIJOLAULMPWMD-UHFFFAOYSA-O | InChI=1S/C27H22FN4O5/c1-36-21-13-11-20(12-14-21)32-24(27(35)37-31-32)17-23(30-25(33)19-8-3-2-4-9-19)26(34)29-16-15-18-7-5-6-10-22(18)28/h2-14,17H,15-16H2,1H3,(H,29,34)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCCc3ccccc3F)\NC(=O)c4ccccc4 | |
| AKOS005252790 | 497.568 | C27 H23 N5 O3 S | HGVVFBRGQRDFPM-HZHRSRAPSA-N | InChI=1S/C27H23N5O3S/c1-18(2)31-16-25(35-30-31)29-24(33)17-36-27-28-23(26(34)32(27)21-12-4-3-5-13-21)15-20-11-8-10-19-9-6-7-14-22(19)20/h3-16,18H,17H2,1-2H3/b23-15+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc4c3cccc4)/C(=O)N2c5ccccc5 | |
| AKOS005253373 | 513.568 | C27 H23 N5 O4 S | ODIAZPWIVHUYLR-XQNSMLJCSA-N | InChI=1S/C27H23N5O4S/c1-35-15-14-31-17-25(36-30-31)29-24(33)18-37-27-28-23(26(34)32(27)21-11-3-2-4-12-21)16-20-10-7-9-19-8-5-6-13-22(19)20/h2-13,16-17H,14-15,18H2,1H3/b23-16+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3cccc4c3cccc4)/C(=O)N2c5ccccc5 | |
| AKOS005250871 | 513.501 | C27 H23 N5 O6 | DIIFTGIHMUDRSU-UHFFFAOYSA-O | InChI=1S/C27H22N5O6/c33-24(19-8-3-1-4-9-19)28-21(18-22-27(36)38-29-32(22)20-10-5-2-6-11-20)25(34)30-13-15-31(16-14-30)26(35)23-12-7-17-37-23/h1-12,17-18H,13-16H2/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CCN(CC4)C(=O)c5ccco5 | |
| AKOS005251977 | 516.634 | C27 H24 N4 O3 S2 | QEXYEMAUGGMULG-UHFFFAOYSA-N | InChI=1S/C27H24N4O3S2/c1-2-22(36-26-27(33)34-30-31(26)19-11-7-4-8-12-19)24(32)29-25-21(16-28)20-14-13-18(15-23(20)35-25)17-9-5-3-6-10-17/h3-12,18,22H,2,13-15H2,1H3,(H-,29,30,32,33) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)c3ccccc3)C#N)Sc4c(on[n+]4c5ccccc5)[O-] | |
| AKOS005251697 | 532.634 | C27 H24 N4 O4 S2 | WPCNVHWUDCQLGO-UHFFFAOYSA-N | InChI=1S/C27H24N4O4S2/c1-16(36-26-27(33)35-30-31(26)19-9-11-20(34-2)12-10-19)24(32)29-25-22(15-28)21-13-8-18(14-23(21)37-25)17-6-4-3-5-7-17/h3-7,9-12,16,18H,8,13-14H2,1-2H3,(H-,29,30,32,33) | CC(C(=O)Nc1c(c2c(s1)CC(CC2)c3ccccc3)C#N)Sc4c(on[n+]4c5ccc(cc5)OC)[O-] | |
| AKOS005252613 | 532.634 | C27 H24 N4 O4 S2 | OADLHJQAEXMSHM-UHFFFAOYSA-N | InChI=1S/C27H24N4O4S2/c1-34-20-10-8-19(9-11-20)31-26(27(33)35-30-31)36-14-13-24(32)29-25-22(16-28)21-12-7-18(15-23(21)37-25)17-5-3-2-4-6-17/h2-6,8-11,18H,7,12-15H2,1H3,(H-,29,30,32,33) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3c(c4c(s3)CC(CC4)c5ccccc5)C#N | |
| AKOS005250991 | 484.503 | C27 H24 N4 O5 | AZIWREXMQNQAFB-UHFFFAOYSA-O | InChI=1S/C27H23N4O5/c1-18-8-10-19(11-9-18)17-28-26(33)23(29-25(32)20-6-4-3-5-7-20)16-24-27(34)36-30-31(24)21-12-14-22(35-2)15-13-21/h3-16H,17H2,1-2H3,(H,28,33)/q-1/p+1 | Cc1ccc(cc1)CNC(=O)/C(=C/c2c(on[n+]2c3ccc(cc3)OC)[O-])/NC(=O)c4ccccc4 | |
| AKOS005250992 | 484.503 | C27 H24 N4 O5 | IBWJWIHGHXRAKS-UHFFFAOYSA-O | InChI=1S/C27H23N4O5/c1-35-22-14-12-21(13-15-22)31-24(27(34)36-30-31)18-23(29-25(32)20-10-6-3-7-11-20)26(33)28-17-16-19-8-4-2-5-9-19/h2-15,18H,16-17H2,1H3,(H,28,33)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCCc3ccccc3)\NC(=O)c4ccccc4 | |
| AKOS005251055 | 484.503 | C27 H24 N4 O5 | OVGGEECMQNWCIT-UHFFFAOYSA-O | InChI=1S/C27H23N4O5/c1-35-22-14-12-19(13-15-22)16-17-28-26(33)23(29-25(32)20-8-4-2-5-9-20)18-24-27(34)36-30-31(24)21-10-6-3-7-11-21/h2-15,18H,16-17H2,1H3,(H,28,33)/q-1/p+1 | COc1ccc(cc1)CCNC(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251075 | 484.503 | C27 H24 N4 O5 | DDQMZXXCOGNACP-UHFFFAOYSA-O | InChI=1S/C27H23N4O5/c1-35-24-15-9-8-10-19(24)16-17-28-26(33)22(29-25(32)20-11-4-2-5-12-20)18-23-27(34)36-30-31(23)21-13-6-3-7-14-21/h2-15,18H,16-17H2,1H3,(H,28,33)/q-1/p+1 | COc1ccccc1CCNC(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251100 | 484.503 | C27 H24 N4 O5 | UXAAEXOWGJAAES-UHFFFAOYSA-O | InChI=1S/C27H23N4O5/c1-18(19-9-5-3-6-10-19)28-26(33)23(29-25(32)20-11-7-4-8-12-20)17-24-27(34)36-30-31(24)21-13-15-22(35-2)16-14-21/h3-18H,1-2H3,(H,28,33)/q-1/p+1 | CC(c1ccccc1)NC(=O)/C(=C/c2c(on[n+]2c3ccc(cc3)OC)[O-])/NC(=O)c4ccccc4 | |
| AKOS005253059 | 496.583 | C27 H24 N6 O2 S | RZWKCHOIEILERU-UHFFFAOYSA-N | InChI=1S/C27H24N6O2S/c28-17-23-22(20-10-4-1-5-11-20)16-24(21-12-6-2-7-13-21)29-27(23)36-19-25(34)30-26-18-33(31-35-26)32-14-8-3-9-15-32/h1-2,4-7,10-13,16,18H,3,8-9,14-15,19H2 | c1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005252947 | 512.583 | C27 H24 N6 O3 S | QZKAQMIPTKPCFI-UHFFFAOYSA-N | InChI=1S/C27H24N6O3S/c1-19-7-9-20(10-8-19)22-15-24(21-5-3-2-4-6-21)29-27(23(22)16-28)37-18-25(34)30-26-17-33(31-36-26)32-11-13-35-14-12-32/h2-10,15,17H,11-14,18H2,1H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005251076 | 496.517 | C27 H24 N6 O4 | SCTPWSQUQSGHFW-UHFFFAOYSA-O | InChI=1S/C27H23N6O4/c34-25(20-9-3-1-4-10-20)29-22(19-23-27(36)37-30-33(23)21-11-5-2-6-12-21)26(35)32-17-15-31(16-18-32)24-13-7-8-14-28-24/h1-14,19H,15-18H2/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CCN(CC4)c5ccccn5 | |
| AKOS005252951 | 528.582 | C27 H24 N6 O4 S | UWDOEMRFNXHIMO-UHFFFAOYSA-N | InChI=1S/C27H24N6O4S/c1-35-21-9-7-19(8-10-21)22-15-24(20-5-3-2-4-6-20)29-27(23(22)16-28)38-18-25(34)30-26-17-33(31-37-26)32-11-13-36-14-12-32/h2-10,15,17H,11-14,18H2,1H3 | COc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005251337 | 512.517 | C27 H24 N6 O5 | MUWASWFOQONFAI-ZQHSETAFSA-N | InChI=1S/C27H24N6O5/c1-31(17-24-27(36)38-30-33(24)21-12-14-22(37-2)15-13-21)23-16-25(34)32(26(23)35)20-10-8-19(9-11-20)29-28-18-6-4-3-5-7-18/h3-15,23H,16-17H2,1-2H3/b29-28+ | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C3CC(=O)N(C3=O)c4ccc(cc4)/N=N/c5ccccc5 | |
| AKOS005251557 | 535.634 | C27 H25 N3 O5 S2 | OJJIALCJRQHUAG-UHFFFAOYSA-N | InChI=1S/C27H25N3O5S2/c1-2-34-26(32)23-20-14-13-18(17-9-5-3-6-10-17)15-21(20)37-24(23)28-22(31)16-36-25-27(33)35-29-30(25)19-11-7-4-8-12-19/h3-12,18H,2,13-16H2,1H3,(H-,28,29,31,32,33) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])CC(CC2)c5ccccc5 | |
| AKOS005251757 | 535.634 | C27 H25 N3 O5 S2 | RSSLAJPRALDSDL-UHFFFAOYSA-N | InChI=1S/C27H25N3O5S2/c1-16(36-25-27(33)35-29-30(25)19-11-7-4-8-12-19)23(31)28-24-22(26(32)34-2)20-14-13-18(15-21(20)37-24)17-9-5-3-6-10-17/h3-12,16,18H,13-15H2,1-2H3,(H-,28,29,31,32,33) | CC(C(=O)Nc1c(c2c(s1)CC(CC2)c3ccccc3)C(=O)OC)Sc4c(on[n+]4c5ccccc5)[O-] | |
| AKOS005252553 | 535.634 | C27 H25 N3 O5 S2 | MRTLIOXKYDHWAJ-UHFFFAOYSA-N | InChI=1S/C27H25N3O5S2/c1-34-26(32)23-20-13-12-18(17-8-4-2-5-9-17)16-21(20)37-24(23)28-22(31)14-15-36-25-27(33)35-29-30(25)19-10-6-3-7-11-19/h2-11,18H,12-16H2,1H3,(H-,28,29,31,32,33) | COC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])CC(CC2)c5ccccc5 | |
| AKOS005250219 | 519.569 | C27 H25 N3 O6 S | GZPQDEOKNKQYJQ-UHFFFAOYSA-N | InChI=1S/C27H25N3O6S/c1-3-35-26(32)22-20-14-9-17(16-7-5-4-6-8-16)15-21(20)37-25(22)28-24(31)23-27(33)36-29-30(23)18-10-12-19(34-2)13-11-18/h4-8,10-13,17H,3,9,14-15H2,1-2H3,(H-,28,29,31,32,33) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])CC(CC2)c5ccccc5 | |
| AKOS005251511 | 551.634 | C27 H25 N3 O6 S2 | KIYGQMNGULJIFU-UHFFFAOYSA-N | InChI=1S/C27H25N3O6S2/c1-34-19-11-9-18(10-12-19)30-25(27(33)36-29-30)37-15-22(31)28-24-23(26(32)35-2)20-13-8-17(14-21(20)38-24)16-6-4-3-5-7-16/h3-7,9-12,17H,8,13-15H2,1-2H3,(H-,28,29,31,32,33) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3c(c4c(s3)CC(CC4)c5ccccc5)C(=O)OC | |
| AKOS005252854 | 499.584 | C27 H25 N5 O3 S | ULVTWYFAPMJWIT-UHFFFAOYSA-N | InChI=1S/C27H25N5O3S/c1-17(2)32-15-26(35-31-32)30-25(33)16-36-27-23(14-28)22(19-7-5-18(3)6-8-19)13-24(29-27)20-9-11-21(34-4)12-10-20/h5-13,15,17H,16H2,1-4H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)C(C)C)c4ccc(cc4)OC | |
| AKOS005251984 | 531.649 | C27 H25 N5 O3 S2 | BQLPTGSMEWHYLN-UHFFFAOYSA-N | InChI=1S/C27H25N5O3S2/c1-2-22(37-26-27(34)35-30-32(26)19-11-7-4-8-12-19)24(33)29-25-21(15-28)20-13-14-31(17-23(20)36-25)16-18-9-5-3-6-10-18/h3-12,22H,2,13-14,16-17H2,1H3,(H-,29,30,33,34) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)Cc3ccccc3)C#N)Sc4c(on[n+]4c5ccccc5)[O-] | |
| AKOS005252845 | 515.584 | C27 H25 N5 O4 S | YWWRDTXUJHCYHY-UHFFFAOYSA-N | InChI=1S/C27H25N5O4S/c1-17(2)32-15-25(36-31-32)30-24(33)16-37-27-21(14-28)20(13-22(29-27)18-9-6-5-7-10-18)19-11-8-12-23(34-3)26(19)35-4/h5-13,15,17H,16H2,1-4H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cccc(c4OC)OC)C#N | |
| AKOS005252879 | 515.584 | C27 H25 N5 O4 S | NVHXWQXHYDBPSW-UHFFFAOYSA-N | InChI=1S/C27H25N5O4S/c1-17(2)32-15-26(36-31-32)30-25(33)16-37-27-22(14-28)20(13-23(29-27)18-8-6-5-7-9-18)21-12-19(34-3)10-11-24(21)35-4/h5-13,15,17H,16H2,1-4H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cc(ccc4OC)OC)C#N | |
| AKOS005253309 | 515.584 | C27 H25 N5 O4 S | PYHJEHGGTAOXBE-UHFFFAOYSA-N | InChI=1S/C27H25N5O4S/c1-18-4-6-19(7-5-18)22-14-24(20-8-10-21(35-3)11-9-20)29-27(23(22)15-28)37-17-25(33)30-26-16-32(31-36-26)12-13-34-2/h4-11,14,16H,12-13,17H2,1-3H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)CCOC)c4ccc(cc4)OC | |
| AKOS005251704 | 547.648 | C27 H25 N5 O4 S2 | CMJKQWCPBQETPO-UHFFFAOYSA-N | InChI=1S/C27H25N5O4S2/c1-17(37-26-27(34)36-30-32(26)19-8-10-20(35-2)11-9-19)24(33)29-25-22(14-28)21-12-13-31(16-23(21)38-25)15-18-6-4-3-5-7-18/h3-11,17H,12-13,15-16H2,1-2H3,(H-,29,30,33,34) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)Cc3ccccc3)C#N)Sc4c(on[n+]4c5ccc(cc5)OC)[O-] | |
| AKOS005252620 | 547.648 | C27 H25 N5 O4 S2 | HAMFIXYJZMBRHE-UHFFFAOYSA-N | InChI=1S/C27H25N5O4S2/c1-35-20-9-7-19(8-10-20)32-26(27(34)36-30-32)37-14-12-24(33)29-25-22(15-28)21-11-13-31(17-23(21)38-25)16-18-5-3-2-4-6-18/h2-10H,11-14,16-17H2,1H3,(H-,29,30,33,34) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3c(c4c(s3)CN(CC4)Cc5ccccc5)C#N | |
| AKOS005252438 | 531.583 | C27 H25 N5 O5 S | BSDOHVKOZRMWDB-UHFFFAOYSA-N | InChI=1S/C27H25N5O5S/c1-5-32-15-25(37-31-32)30-24(33)16-38-27-20(14-28)19(13-21(29-27)17-9-7-6-8-10-17)18-11-22(34-2)26(36-4)23(12-18)35-3/h6-13,15H,5,16H2,1-4H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cc(c(c(c4)OC)OC)OC)C#N | |
| AKOS005253306 | 531.583 | C27 H25 N5 O5 S | QYMPQDNRMSYVLZ-UHFFFAOYSA-N | InChI=1S/C27H25N5O5S/c1-34-13-12-32-16-25(37-31-32)30-24(33)17-38-27-21(15-28)20(14-22(29-27)18-8-5-4-6-9-18)19-10-7-11-23(35-2)26(19)36-3/h4-11,14,16H,12-13,17H2,1-3H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cccc(c4OC)OC)C#N | |
| AKOS005253316 | 531.583 | C27 H25 N5 O5 S | LCLOPKSCRZLJME-UHFFFAOYSA-N | InChI=1S/C27H25N5O5S/c1-34-12-11-32-16-26(37-31-32)30-25(33)17-38-27-22(15-28)20(14-23(29-27)18-7-5-4-6-8-18)21-13-19(35-2)9-10-24(21)36-3/h4-10,13-14,16H,11-12,17H2,1-3H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cc(ccc4OC)OC)C#N | |
| AKOS005250999 | 563.582 | C27 H25 N5 O7 S | OYWBLSNRLMLXJO-UHFFFAOYSA-O | InChI=1S/C27H24N5O7S/c1-38-21-11-9-20(10-12-21)32-24(27(35)39-31-32)17-23(30-25(33)19-5-3-2-4-6-19)26(34)29-16-15-18-7-13-22(14-8-18)40(28,36)37/h2-14,17H,15-16H2,1H3,(H3,28,29,34,36,37)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCCc3ccc(cc3)S(=O)(=O)N)\NC(=O)c4ccccc4 | |
| AKOS005250985 | 527.531 | C27 H25 N7 O5 | ULWCHDRRUGWDNU-UHFFFAOYSA-O | InChI=1S/C27H24N7O5/c1-38-21-10-8-20(9-11-21)34-23(26(37)39-31-34)18-22(30-24(35)19-6-3-2-4-7-19)25(36)32-14-16-33(17-15-32)27-28-12-5-13-29-27/h2-13,18H,14-17H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCN(CC3)c4ncccn4)\NC(=O)c5ccccc5 | |
| AKOS005251564 | 550.649 | C27 H26 N4 O5 S2 | NSLCCGISYCSSOM-UHFFFAOYSA-N | InChI=1S/C27H26N4O5S2/c1-2-35-26(33)23-20-13-14-30(15-18-9-5-3-6-10-18)16-21(20)38-24(23)28-22(32)17-37-25-27(34)36-29-31(25)19-11-7-4-8-12-19/h3-12H,2,13-17H2,1H3,(H-,28,29,32,33,34) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccccc4)[O-])CN(CC2)Cc5ccccc5 | |
| AKOS005251666 | 550.649 | C27 H26 N4 O5 S2 | IHFYVDBXYAFXHR-UHFFFAOYSA-N | InChI=1S/C27H26N4O5S2/c1-17(37-25-27(34)36-29-31(25)19-11-7-4-8-12-19)23(32)28-24-22(26(33)35-2)20-13-14-30(16-21(20)38-24)15-18-9-5-3-6-10-18/h3-12,17H,13-16H2,1-2H3,(H-,28,29,32,33,34) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)Cc3ccccc3)C(=O)OC)Sc4c(on[n+]4c5ccccc5)[O-] | |
| AKOS005252559 | 550.649 | C27 H26 N4 O5 S2 | ADBDPYITIWOVOM-UHFFFAOYSA-N | InChI=1S/C27H26N4O5S2/c1-35-26(33)23-20-12-14-30(16-18-8-4-2-5-9-18)17-21(20)38-24(23)28-22(32)13-15-37-25-27(34)36-29-31(25)19-10-6-3-7-11-19/h2-11H,12-17H2,1H3,(H-,28,29,32,33,34) | COC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])CN(CC2)Cc5ccccc5 | |
| AKOS005219792 | 502.519 | C27 H26 N4 O6 | CMDUUZVHEPHXAN-UHFFFAOYSA-N | InChI=1S/C27H26N4O6/c1-36-23-14-12-22(13-15-23)31-24(27(35)37-28-31)17-30(16-20-8-4-2-5-9-20)25(32)18-29(19-26(33)34)21-10-6-3-7-11-21/h2-15H,16-19H2,1H3,(H-,28,33,34,35) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(Cc3ccccc3)C(=O)CN(CC(=O)O)c4ccccc4 | |
| AKOS005250171 | 534.584 | C27 H26 N4 O6 S | MHHPGEOECFXMCW-UHFFFAOYSA-N | InChI=1S/C27H26N4O6S/c1-3-36-26(33)22-20-13-14-30(15-17-7-5-4-6-8-17)16-21(20)38-25(22)28-24(32)23-27(34)37-29-31(23)18-9-11-19(35-2)12-10-18/h4-12H,3,13-16H2,1-2H3,(H-,28,29,32,33,34) | CCOC(=O)c1c2c(sc1NC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])CN(CC2)Cc5ccccc5 | |
| AKOS005251512 | 566.649 | C27 H26 N4 O6 S2 | HALDPLQVSQYMGK-UHFFFAOYSA-N | InChI=1S/C27H26N4O6S2/c1-35-19-10-8-18(9-11-19)31-25(27(34)37-29-31)38-16-22(32)28-24-23(26(33)36-2)20-12-13-30(15-21(20)39-24)14-17-6-4-3-5-7-17/h3-11H,12-16H2,1-2H3,(H-,28,29,32,33,34) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCC(=O)Nc3c(c4c(s3)CN(CC4)Cc5ccccc5)C(=O)OC | |
| AKOS005252403 | 566.649 | C27 H26 N4 O6 S2 | PMRYRJGHSNICOG-UHFFFAOYSA-N | InChI=1S/C27H26N4O6S2/c1-4-19(38-25-27(35)37-30-31(25)18-14-10-7-11-15-18)22(32)29-24-20(26(34)36-5-2)16(3)21(39-24)23(33)28-17-12-8-6-9-13-17/h6-15,19H,4-5H2,1-3H3,(H2-,28,29,30,32,33,34,35) | CCC(C(=O)Nc1c(c(c(s1)C(=O)Nc2ccccc2)C)C(=O)OCC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251680 | 582.648 | C27 H26 N4 O7 S2 | HBUDUOADTNFWLV-UHFFFAOYSA-N | InChI=1S/C27H26N4O7S2/c1-5-37-26(34)20-15(2)21(23(33)28-17-9-7-6-8-10-17)40-24(20)29-22(32)16(3)39-25-27(35)38-30-31(25)18-11-13-19(36-4)14-12-18/h6-14,16H,5H2,1-4H3,(H2-,28,29,30,32,33,34,35) | CCOC(=O)c1c(c(sc1NC(=O)C(C)Sc2c(on[n+]2c3ccc(cc3)OC)[O-])C(=O)Nc4ccccc4)C | |
| AKOS005252285 | 582.648 | C27 H26 N4 O7 S2 | MYEBFQSXWVVZHF-UHFFFAOYSA-N | InChI=1S/C27H26N4O7S2/c1-5-19(39-25-27(35)38-30-31(25)17-11-13-18(36-3)14-12-17)22(32)29-24-20(26(34)37-4)15(2)21(40-24)23(33)28-16-9-7-6-8-10-16/h6-14,19H,5H2,1-4H3,(H2-,28,29,30,32,33,34,35) | CCC(C(=O)Nc1c(c(c(s1)C(=O)Nc2ccccc2)C)C(=O)OC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252608 | 582.648 | C27 H26 N4 O7 S2 | LWAMKORIJRDNNP-UHFFFAOYSA-N | InChI=1S/C27H26N4O7S2/c1-4-37-26(34)21-16(2)22(23(33)28-17-8-6-5-7-9-17)40-24(21)29-20(32)14-15-39-25-27(35)38-30-31(25)18-10-12-19(36-3)13-11-18/h5-13H,4,14-15H2,1-3H3,(H2-,28,29,30,32,33,34,35) | CCOC(=O)c1c(c(sc1NC(=O)CCSc2c(on[n+]2c3ccc(cc3)OC)[O-])C(=O)Nc4ccccc4)C | |
| AKOS005253085 | 514.599 | C27 H26 N6 O3 S | KAMCSJCSGDIYQN-MZZZYUEISA-N | InChI=1S/C27H26N6O3S/c34-24(29-25-19-32(30-36-25)31-17-8-3-9-18-31)20-37-27-28-23(16-10-13-21-11-4-1-5-12-21)26(35)33(27)22-14-6-2-7-15-22/h1-2,4-7,10-16,19H,3,8-9,17-18,20H2/b13-10+,23-16+ | c1ccc(cc1)/C=C/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005252753 | 546.598 | C27 H26 N6 O5 S | BMTMSYAGAZJJFS-UHFFFAOYSA-N | InChI=1S/C27H26N6O5S/c1-32(2)33-15-25(38-31-33)30-24(34)16-39-27-20(14-28)19(13-21(29-27)17-9-7-6-8-10-17)18-11-22(35-3)26(37-5)23(12-18)36-4/h6-13,15H,16H2,1-5H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cc(c(c(c4)OC)OC)OC)C#N | |
| AKOS005254008 | 546.598 | C27 H26 N6 O5 S | SWIOJHRHVZUSLJ-UHFFFAOYSA-N | InChI=1S/C27H26N6O5S/c1-16(34)17-8-10-19(11-9-17)28-23(35)14-21-26(37)33(20-12-13-20)27(39)32(21)15-22-25(38-30-31(22)2)29-24(36)18-6-4-3-5-7-18/h3-11,20-21H,12-15H2,1-2H3,(H-,28,29,30,34,35,36) | CC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)C5CC5 | |
| AKOS005254013 | 562.597 | C27 H26 N6 O6 S | JFJHNQJFGBMOSR-UHFFFAOYSA-N | InChI=1S/C27H26N6O6S/c1-31-21(24(39-30-31)29-23(35)16-6-4-3-5-7-16)15-32-20(25(36)33(27(32)40)19-12-13-19)14-22(34)28-18-10-8-17(9-11-18)26(37)38-2/h3-11,19-20H,12-15H2,1-2H3,(H-,28,29,30,34,35,37) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)C(=O)OC | |
| AKOS005253965 | 561.612 | C27 H27 N7 O5 S | GBOLUNXAJZKMFY-UHFFFAOYSA-N | InChI=1S/C27H27N7O5S/c1-16(35)28-18-8-10-19(11-9-18)29-23(36)14-21-26(38)34(20-12-13-20)27(40)33(21)15-22-25(39-31-32(22)2)30-24(37)17-6-4-3-5-7-17/h3-11,20-21,31H,12-15H2,1-2H3,(H,30,37) | CC(=O)Nc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)C5CC5 | |
| AKOS005251097 | 488.535 | C27 H28 N4 O5 | GIMHGBCHGVSEQI-UHFFFAOYSA-O | InChI=1S/C27H27N4O5/c1-35-22-14-12-21(13-15-22)31-24(27(34)36-30-31)18-23(29-25(32)20-10-6-3-7-11-20)26(33)28-17-16-19-8-4-2-5-9-19/h3,6-8,10-15,18H,2,4-5,9,16-17H2,1H3,(H,28,33)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCCC3=CCCCC3)\NC(=O)c4ccccc4 | |
| AKOS005250884 | 520.534 | C27 H28 N4 O7 | LVMATBIZFNPEBV-UHFFFAOYSA-O | InChI=1S/C27H27N4O7/c1-3-37-26(34)19-13-15-30(16-14-19)25(33)22(28-24(32)18-7-5-4-6-8-18)17-23-27(35)38-29-31(23)20-9-11-21(36-2)12-10-20/h4-12,17,19H,3,13-16H2,1-2H3/q-1/p+1 | CCOC(=O)C1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2c3ccc(cc3)OC)[O-])/NC(=O)c4ccccc4 | |
| AKOS005250885 | 520.534 | C27 H28 N4 O7 | BUNJPTPPVUBHDU-UHFFFAOYSA-O | InChI=1S/C27H27N4O7/c1-3-37-26(34)19-10-7-15-30(17-19)25(33)22(28-24(32)18-8-5-4-6-9-18)16-23-27(35)38-29-31(23)20-11-13-21(36-2)14-12-20/h4-6,8-9,11-14,16,19H,3,7,10,15,17H2,1-2H3/q-1/p+1 | CCOC(=O)C1CCCN(C1)C(=O)/C(=C/c2c(on[n+]2c3ccc(cc3)OC)[O-])/NC(=O)c4ccccc4 | |
| AKOS005253014 | 532.614 | C27 H28 N6 O4 S | NZSINCYOPIMBFG-XQNSMLJCSA-N | InChI=1S/C27H28N6O4S/c1-19(2)21-10-8-20(9-11-21)16-23-26(35)33(22-6-4-3-5-7-22)27(28-23)38-18-24(34)29-25-17-32(30-37-25)31-12-14-36-15-13-31/h3-11,16-17,19H,12-15,18H2,1-2H3/b23-16+ | CC(C)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005253109 | 532.614 | C27 H28 N6 O4 S | PMTBDRZKFQVVLX-OQKWZONESA-N | InChI=1S/C27H28N6O4S/c1-2-36-23-14-8-7-11-20(23)17-22-26(35)33(21-12-5-3-6-13-21)27(28-22)38-19-24(34)29-25-18-32(30-37-25)31-15-9-4-10-16-31/h3,5-8,11-14,17-18H,2,4,9-10,15-16,19H2,1H3/b22-17+ | CCOc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005253115 | 532.614 | C27 H28 N6 O4 S | OIZSCTWNOZNDFX-HAVVHWLPSA-N | InChI=1S/C27H28N6O4S/c1-2-36-22-13-11-20(12-14-22)17-23-26(35)33(21-9-5-3-6-10-21)27(28-23)38-19-24(34)29-25-18-32(30-37-25)31-15-7-4-8-16-31/h3,5-6,9-14,17-18H,2,4,7-8,15-16,19H2,1H3/b23-17+ | CCOc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005253072 | 548.613 | C27 H28 N6 O5 S | QJTXYGVLHLMKJX-CJLVFECKSA-N | InChI=1S/C27H28N6O5S/c1-36-21-11-12-23(37-2)19(15-21)16-22-26(35)33(20-9-5-3-6-10-20)27(28-22)39-18-24(34)29-25-17-32(30-38-25)31-13-7-4-8-14-31/h3,5-6,9-12,15-17H,4,7-8,13-14,18H2,1-2H3/b22-16+ | COc1ccc(c(c1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5)OC | |
| AKOS005253079 | 548.613 | C27 H28 N6 O5 S | HIHRLVRUSIZFRQ-RCCKNPSSSA-N | InChI=1S/C27H28N6O5S/c1-36-22-12-11-19(16-23(22)37-2)15-21-26(35)33(20-9-5-3-6-10-20)27(28-21)39-18-24(34)29-25-17-32(30-38-25)31-13-7-4-8-14-31/h3,5-6,9-12,15-17H,4,7-8,13-14,18H2,1-2H3/b21-15+ | COc1ccc(cc1OC)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005253126 | 548.613 | C27 H28 N6 O5 S | LHHOWSJSRJAISB-LTGZKZEYSA-N | InChI=1S/C27H28N6O5S/c1-36-22-13-9-10-19(25(22)37-2)16-21-26(35)33(20-11-5-3-6-12-20)27(28-21)39-18-23(34)29-24-17-32(30-38-24)31-14-7-4-8-15-31/h3,5-6,9-13,16-17H,4,7-8,14-15,18H2,1-2H3/b21-16+ | COc1cccc(c1OC)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005253133 | 548.613 | C27 H28 N6 O5 S | SMMFRLAQBFBFSD-PXLXIMEGSA-N | InChI=1S/C27H28N6O5S/c1-36-21-12-11-19(23(16-21)37-2)15-22-26(35)33(20-9-5-3-6-10-20)27(28-22)39-18-24(34)29-25-17-32(30-38-25)31-13-7-4-8-14-31/h3,5-6,9-12,15-17H,4,7-8,13-14,18H2,1-2H3/b22-15+ | COc1ccc(c(c1)OC)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005253994 | 548.613 | C27 H28 N6 O5 S | OYBMOAFWRVZBFY-UHFFFAOYSA-N | InChI=1S/C27H28N6O5S/c1-3-37-20-13-9-18(10-14-20)28-23(34)15-21-26(36)33(19-11-12-19)27(39)32(21)16-22-25(38-30-31(22)2)29-24(35)17-7-5-4-6-8-17/h4-10,13-14,19,21H,3,11-12,15-16H2,1-2H3,(H-,28,29,30,34,35) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)C5CC5 | |
| AKOS005253996 | 564.613 | C27 H28 N6 O6 S | QABZFNKZRMKUCA-UHFFFAOYSA-N | InChI=1S/C27H28N6O6S/c1-4-32-25(36)20(15-22(34)28-19-13-11-18(12-14-19)26(37)38-5-2)33(27(32)40)16-21-24(39-30-31(21)3)29-23(35)17-9-7-6-8-10-17/h6-14,20H,4-5,15-16H2,1-3H3,(H-,28,29,30,34,35,37) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)C(=O)OCC | |
| AKOS005254162 | 596.678 | C27 H28 N6 O6 S2 | WPMMPGBHWKCQHT-UHFFFAOYSA-N | InChI=1S/C27H28N6O6S2/c1-16-4-12-21(13-5-16)41(37,38)29-25-23(31(3)30-39-25)15-32-22(26(36)33(27(32)40)20-10-11-20)14-24(35)28-19-8-6-18(7-9-19)17(2)34/h4-9,12-13,20,22H,10-11,14-15H2,1-3H3,(H-,28,29,30,34,35) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)C(=O)C | |
| AKOS005252986 | 580.612 | C27 H28 N6 O7 S | DLIGMWRLTQKSNY-DEDYPNTBSA-N | InChI=1S/C27H28N6O7S/c1-36-21-15-23(38-3)22(37-2)14-18(21)13-20-26(35)33(19-7-5-4-6-8-19)27(28-20)41-17-24(34)29-25-16-32(30-40-25)31-9-11-39-12-10-31/h4-8,13-16H,9-12,17H2,1-3H3/b20-13+ | COc1cc(c(cc1OC)OC)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005252991 | 580.612 | C27 H28 N6 O7 S | YTTGFXPTSQPAQL-DEDYPNTBSA-N | InChI=1S/C27H28N6O7S/c1-36-21-14-18(15-22(37-2)25(21)38-3)13-20-26(35)33(19-7-5-4-6-8-19)27(28-20)41-17-23(34)29-24-16-32(30-40-24)31-9-11-39-12-10-31/h4-8,13-16H,9-12,17H2,1-3H3/b20-13+ | COc1cc(cc(c1OC)OC)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005254163 | 612.677 | C27 H28 N6 O7 S2 | IIAVJTCCAYDIDY-UHFFFAOYSA-N | InChI=1S/C27H28N6O7S2/c1-16-4-12-20(13-5-16)42(37,38)29-24-22(31(2)30-40-24)15-32-21(25(35)33(27(32)41)19-10-11-19)14-23(34)28-18-8-6-17(7-9-18)26(36)39-3/h4-9,12-13,19,21H,10-11,14-15H2,1-3H3,(H-,28,29,30,34,36) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)C(=O)OC | |
| AKOS005251063 | 519.549 | C27 H29 N5 O6 | YBQVOJMJZJMJEN-UHFFFAOYSA-O | InChI=1S/C27H28N5O6/c1-27(2,3)37-26(36)31-16-14-30(15-17-31)24(34)21(28-23(33)19-10-6-4-7-11-19)18-22-25(35)38-29-32(22)20-12-8-5-9-13-20/h4-13,18H,14-17H2,1-3H3/q-1/p+1 | CC(C)(C)OC(=O)N1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005253086 | 531.629 | C27 H29 N7 O3 S | FAGUJCSEVSQJRR-HAVVHWLPSA-N | InChI=1S/C27H29N7O3S/c1-31(2)21-13-11-20(12-14-21)17-23-26(36)34(22-9-5-3-6-10-22)27(28-23)38-19-24(35)29-25-18-33(30-37-25)32-15-7-4-8-16-32/h3,5-6,9-14,17-18H,4,7-8,15-16,19H2,1-2H3/b23-17+ | CN(C)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005254165 | 611.692 | C27 H29 N7 O6 S2 | VDOVREWTDNNISU-UHFFFAOYSA-O | InChI=1S/C27H28N7O6S2/c1-16-4-12-21(13-5-16)42(38,39)30-25-23(32(3)31-40-25)15-33-22(26(37)34(27(33)41)20-10-11-20)14-24(36)29-19-8-6-18(7-9-19)28-17(2)35/h4-9,12-13,20,22,31H,10-11,14-15H2,1-3H3/q-1/p+1 | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)NC(=O)C | |
| AKOS005252905 | 518.63 | C27 H30 N6 O3 S | DLLFRARWLJVGAZ-XQNSMLJCSA-N | InChI=1S/C27H30N6O3S/c1-5-31(6-2)21-14-12-20(13-15-21)16-23-26(35)33(22-10-8-7-9-11-22)27(28-23)37-18-24(34)29-25-17-32(19(3)4)30-36-25/h7-17,19H,5-6,18H2,1-4H3/b23-16+ | CCN(CC)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)C(C)C)c4ccccc4 | |
| AKOS005253371 | 534.63 | C27 H30 N6 O4 S | YTIKLKBAQSDDFS-HAVVHWLPSA-N | InChI=1S/C27H30N6O4S/c1-4-31(5-2)21-13-11-20(12-14-21)17-23-26(35)33(22-9-7-6-8-10-22)27(28-23)38-19-24(34)29-25-18-32(30-37-25)15-16-36-3/h6-14,17-18H,4-5,15-16,19H2,1-3H3/b23-17+ | CCN(CC)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)CCOC)c4ccccc4 | |
| AKOS005254130 | 598.694 | C27 H30 N6 O6 S2 | ARQRGWBKGVZEON-UHFFFAOYSA-N | InChI=1S/C27H30N6O6S2/c1-4-38-20-11-7-18(8-12-20)28-24(34)15-22-26(35)33(19-9-10-19)27(40)32(22)16-23-25(39-30-31(23)3)29-41(36,37)21-13-5-17(2)6-14-21/h5-8,11-14,19,22H,4,9-10,15-16H2,1-3H3,(H-,28,29,30,34) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)C5CC5 | |
| AKOS005254188 | 614.693 | C27 H30 N6 O7 S2 | BMPYAOHELMKEOT-UHFFFAOYSA-N | InChI=1S/C27H30N6O7S2/c1-5-32-25(35)21(15-23(34)28-19-11-9-18(10-12-19)26(36)39-6-2)33(27(32)41)16-22-24(40-30-31(22)4)29-42(37,38)20-13-7-17(3)8-14-20/h7-14,21H,5-6,15-16H2,1-4H3,(H-,28,29,30,34,36) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)C(=O)OCC | |
| AKOS005254095 | 569.629 | C27 H31 N5 O7 S | NCSKLHSBVYUWIV-UHFFFAOYSA-N | InChI=1S/C27H31N5O7S/c1-17(2)32-23(26(39-30-32)29-40(36,37)22-11-5-18(3)6-12-22)16-31-13-14-38-24(27(31)35)15-25(34)28-21-9-7-20(8-10-21)19(4)33/h5-12,17,24H,13-16H2,1-4H3,(H-,28,29,30,33,34) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)C(=O)C | |
| AKOS005254097 | 585.629 | C27 H31 N5 O8 S | CQNNFYQLVBKJHJ-UHFFFAOYSA-N | InChI=1S/C27H31N5O8S/c1-17(2)32-22(25(40-30-32)29-41(36,37)21-11-5-18(3)6-12-21)16-31-13-14-39-23(26(31)34)15-24(33)28-20-9-7-19(8-10-20)27(35)38-4/h5-12,17,23H,13-16H2,1-4H3,(H-,28,29,30,33,35) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)C(=O)OC | |
| AKOS005252395 | 588.696 | C27 H32 N4 O7 S2 | VIZUFUNXACQQAL-UHFFFAOYSA-N | InChI=1S/C27H32N4O7S2/c1-6-18(40-23-25(34)38-29-31(23)16-11-9-8-10-12-16)21(32)28-22-20(24(33)36-7-2)17-13-14-30(15-19(17)39-22)26(35)37-27(3,4)5/h8-12,18H,6-7,13-15H2,1-5H3,(H-,28,29,32,33,34) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)OC(C)(C)C)C(=O)OCC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251734 | 604.695 | C27 H32 N4 O8 S2 | VNFHNRVTRZONSR-UHFFFAOYSA-N | InChI=1S/C27H32N4O8S2/c1-7-37-24(33)20-18-12-13-30(26(35)38-27(3,4)5)14-19(18)41-22(20)28-21(32)15(2)40-23-25(34)39-29-31(23)16-8-10-17(36-6)11-9-16/h8-11,15H,7,12-14H2,1-6H3,(H-,28,29,32,33,34) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccc(cc4)OC)[O-])CN(CC2)C(=O)OC(C)(C)C | |
| AKOS005252278 | 604.695 | C27 H32 N4 O8 S2 | BVTDSMMMBXSFNY-UHFFFAOYSA-N | InChI=1S/C27H32N4O8S2/c1-7-18(41-23-25(34)39-29-31(23)15-8-10-16(36-5)11-9-15)21(32)28-22-20(24(33)37-6)17-12-13-30(14-19(17)40-22)26(35)38-27(2,3)4/h8-11,18H,7,12-14H2,1-6H3,(H-,28,29,32,33,34) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)OC(C)(C)C)C(=O)OC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252595 | 604.695 | C27 H32 N4 O8 S2 | BCSHNKYENCJDCU-UHFFFAOYSA-N | InChI=1S/C27H32N4O8S2/c1-6-37-24(33)21-18-11-13-30(26(35)38-27(2,3)4)15-19(18)41-22(21)28-20(32)12-14-40-23-25(34)39-29-31(23)16-7-9-17(36-5)10-8-16/h7-10H,6,11-15H2,1-5H3,(H-,28,29,32,33,34) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])CN(CC2)C(=O)OC(C)(C)C | |
| AKOS005254105 | 584.644 | C27 H32 N6 O7 S | DLIHUSODNVPGMX-UHFFFAOYSA-O | InChI=1S/C27H31N6O7S/c1-17(2)33-23(26(40-31-33)30-41(37,38)22-11-5-18(3)6-12-22)16-32-13-14-39-24(27(32)36)15-25(35)29-21-9-7-20(8-10-21)28-19(4)34/h5-12,17,24,31H,13-16H2,1-4H3/q-1/p+1 | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)NC(=O)C | |
| AKOS005251956 | 543.698 | C27 H33 N3 O5 S2 | MZRSAVWOMKRNOW-UHFFFAOYSA-N | InChI=1S/C27H33N3O5S2/c1-6-19(37-24-26(33)35-29-30(24)17-11-9-8-10-12-17)22(31)28-23-21(25(32)34-7-2)18-14-13-16(27(3,4)5)15-20(18)36-23/h8-12,16,19H,6-7,13-15H2,1-5H3,(H-,28,29,31,32,33) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C(C)(C)C)C(=O)OCC)Sc3c(on[n+]3c4ccccc4)[O-] | |
| AKOS005251685 | 559.697 | C27 H33 N3 O6 S2 | VOANXSKKTIAQPE-UHFFFAOYSA-N | InChI=1S/C27H33N3O6S2/c1-7-35-25(32)21-19-13-8-16(27(3,4)5)14-20(19)38-23(21)28-22(31)15(2)37-24-26(33)36-29-30(24)17-9-11-18(34-6)12-10-17/h9-12,15-16H,7-8,13-14H2,1-6H3,(H-,28,29,31,32,33) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccc(cc4)OC)[O-])CC(CC2)C(C)(C)C | |
| AKOS005252394 | 559.697 | C27 H33 N3 O6 S2 | XZTCNIFWVHRGHE-UHFFFAOYSA-N | InChI=1S/C27H33N3O6S2/c1-7-19(38-24-26(33)36-29-30(24)16-9-11-17(34-5)12-10-16)22(31)28-23-21(25(32)35-6)18-13-8-15(27(2,3)4)14-20(18)37-23/h9-12,15,19H,7-8,13-14H2,1-6H3,(H-,28,29,31,32,33) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C(C)(C)C)C(=O)OC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252607 | 559.697 | C27 H33 N3 O6 S2 | UEBJZJZESLCZHP-UHFFFAOYSA-N | InChI=1S/C27H33N3O6S2/c1-6-35-25(32)22-19-12-7-16(27(2,3)4)15-20(19)38-23(22)28-21(31)13-14-37-24-26(33)36-29-30(24)17-8-10-18(34-5)11-9-17/h8-11,16H,6-7,12-15H2,1-5H3,(H-,28,29,31,32,33) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])CC(CC2)C(C)(C)C | |
| AKOS005254096 | 571.645 | C27 H33 N5 O7 S | HJVZUVRETYXIIF-UHFFFAOYSA-N | InChI=1S/C27H33N5O7S/c1-5-37-21-10-8-20(9-11-21)28-25(33)16-24-27(34)31(14-15-38-24)17-23-26(39-30-32(23)18(2)3)29-40(35,36)22-12-6-19(4)7-13-22/h6-13,18,24H,5,14-17H2,1-4H3,(H-,28,29,30,33) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3C(C)C)[N-]S(=O)(=O)c4ccc(cc4)C | |
| AKOS005253763 | 560.958 | C28 H15 Cl F2 N4 O3 S | LQVDLNUMZQXMHO-UHFFFAOYSA-N | InChI=1S/C28H15ClF2N4O3S/c29-15-8-6-14(7-9-15)21-13-19(18-11-10-16(30)12-20(18)31)22-23(32)26(39-27(22)33-21)25(36)24-28(37)38-34-35(24)17-4-2-1-3-5-17/h1-13H,(H2-,32,34,36,37) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5ccc(cc5)Cl)c6ccc(cc6F)F)N | |
| AKOS005253742 | 542.968 | C28 H16 Cl F N4 O3 S | JFZBMDUFRYMGNT-UHFFFAOYSA-N | InChI=1S/C28H16ClFN4O3S/c29-17-11-9-15(10-12-17)21-14-20(16-5-4-6-18(30)13-16)22-23(31)26(38-27(22)32-21)25(35)24-28(36)37-33-34(24)19-7-2-1-3-8-19/h1-14H,(H2-,31,33,35,36) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5ccc(cc5)Cl)c6cccc(c6)F)N | |
| AKOS005253770 | 526.513 | C28 H16 F2 N4 O3 S | OXVUQFLONRWWLJ-UHFFFAOYSA-N | InChI=1S/C28H16F2N4O3S/c29-16-11-12-18(20(30)13-16)19-14-21(15-7-3-1-4-8-15)32-27-22(19)23(31)26(38-27)25(35)24-28(36)37-33-34(24)17-9-5-2-6-10-17/h1-14H,(H2-,31,33,35,36) | c1ccc(cc1)c2cc(c3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6ccc(cc6F)F | |
| AKOS005253718 | 508.523 | C28 H17 F N4 O3 S | BUPBUGQQWNNHOX-UHFFFAOYSA-N | InChI=1S/C28H17FN4O3S/c29-18-11-7-10-17(14-18)20-15-21(16-8-3-1-4-9-16)31-27-22(20)23(30)26(37-27)25(34)24-28(35)36-32-33(24)19-12-5-2-6-13-19/h1-15H,(H2-,30,32,34,35) | c1ccc(cc1)c2cc(c3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6cccc(c6)F | |
| AKOS005253867 | 546.52 | C28 H17 F3 N4 O3 S | XFYICJJRMAITFE-UHFFFAOYSA-N | InChI=1S/C28H17F3N4O3S/c1-35-23(27(37)38-34-35)24(36)25-22(32)21-19(15-9-11-16(12-10-15)28(29,30)31)13-20(33-26(21)39-25)18-8-4-6-14-5-2-3-7-17(14)18/h2-13H,1H3,(H2-,32,34,36,37) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4cccc5c4cccc5)c6ccc(cc6)C(F)(F)F)N | |
| AKOS005250799 | 490.533 | C28 H18 N4 O3 S | DDPGKHKBDOZTJO-UHFFFAOYSA-N | InChI=1S/C28H18N4O3S/c29-17-23-22(19-10-4-1-5-11-19)16-24(20-12-6-2-7-13-20)30-27(23)36-18-25(33)26-28(34)35-31-32(26)21-14-8-3-9-15-21/h1-16H,18H2 | c1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005253687 | 490.533 | C28 H18 N4 O3 S | ZOWMKHRRURJUMI-UHFFFAOYSA-N | InChI=1S/C28H18N4O3S/c29-23-22-20(17-10-4-1-5-11-17)16-21(18-12-6-2-7-13-18)30-27(22)36-26(23)25(33)24-28(34)35-31-32(24)19-14-8-3-9-15-19/h1-16H,(H2-,29,31,33,34) | c1ccc(cc1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6ccccc6 | |
| AKOS005253896 | 492.548 | C28 H20 N4 O3 S | MZTTWOSHLQHDJF-UHFFFAOYSA-N | InChI=1S/C28H20N4O3S/c1-15-10-12-17(13-11-15)20-14-21(19-9-5-7-16-6-3-4-8-18(16)19)30-27-22(20)23(29)26(36-27)25(33)24-28(34)35-31-32(24)2/h3-14H,1-2H3,(H2-,29,31,33,34) | Cc1ccc(cc1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4C)[O-])N)c5cccc6c5cccc6 | |
| AKOS005250845 | 508.548 | C28 H20 N4 O4 S | UBXRWKXRKFEUKT-QSUZBBGVSA-N | InChI=1S/C28H20N4O4S/c33-24(25-27(35)36-30-32(25)22-16-8-3-9-17-22)19-37-28-29-23(18-10-13-20-11-4-1-5-12-20)26(34)31(28)21-14-6-2-7-15-21/h1-18H,19H2/b13-10+,23-18+ | c1ccc(cc1)/C=C/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005253897 | 508.548 | C28 H20 N4 O4 S | KZOFVLKHDINSBG-UHFFFAOYSA-N | InChI=1S/C28H20N4O4S/c1-32-24(28(34)36-31-32)25(33)26-23(29)22-20(16-10-12-17(35-2)13-11-16)14-21(30-27(22)37-26)19-9-5-7-15-6-3-4-8-18(15)19/h3-14H,1-2H3,(H2-,29,31,33,34) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4cccc5c4cccc5)c6ccc(cc6)OC)N | |
| AKOS005250775 | 556.546 | C28 H20 N4 O7 S | RDMYJIJCNGJDPJ-FYJGNVAPSA-N | InChI=1S/C28H20N4O7S/c1-36-20-10-8-19(9-11-20)32-25(27(35)39-30-32)22(33)15-40-28-29-21(26(34)31(28)18-5-3-2-4-6-18)13-17-7-12-23-24(14-17)38-16-37-23/h2-14H,15-16H2,1H3/b21-13+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccc5c(c4)OCO5)/C(=O)N3c6ccccc6 | |
| AKOS005250666 | 526.563 | C28 H22 N4 O5 S | DGVHCYXVAGSMSF-OQKWZONESA-N | InChI=1S/C28H22N4O5S/c1-2-36-24-16-10-9-11-19(24)17-22-26(34)31(20-12-5-3-6-13-20)28(29-22)38-18-23(33)25-27(35)37-30-32(25)21-14-7-4-8-15-21/h3-17H,2,18H2,1H3/b22-17+ | CCOc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005250759 | 526.563 | C28 H22 N4 O5 S | MALJVNPJGMTTQR-HAVVHWLPSA-N | InChI=1S/C28H22N4O5S/c1-2-36-22-15-13-19(14-16-22)17-23-26(34)31(20-9-5-3-6-10-20)28(29-23)38-18-24(33)25-27(35)37-30-32(25)21-11-7-4-8-12-21/h3-17H,2,18H2,1H3/b23-17+ | CCOc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005250776 | 526.563 | C28 H22 N4 O5 S | BBYWSHPCRGTNIW-XQNSMLJCSA-N | InChI=1S/C28H22N4O5S/c1-18-8-6-7-9-19(18)16-23-26(34)31(20-10-4-3-5-11-20)28(29-23)38-17-24(33)25-27(35)37-30-32(25)21-12-14-22(36-2)15-13-21/h3-16H,17H2,1-2H3/b23-16+ | Cc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])c5ccccc5 | |
| AKOS005250855 | 526.563 | C28 H22 N4 O5 S | PNFDPUGWOVWBTE-XQNSMLJCSA-N | InChI=1S/C28H22N4O5S/c1-18-7-6-8-19(15-18)16-23-26(34)31(20-9-4-3-5-10-20)28(29-23)38-17-24(33)25-27(35)37-30-32(25)21-11-13-22(36-2)14-12-21/h3-16H,17H2,1-2H3/b23-16+ | Cc1cccc(c1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])c5ccccc5 | |
| AKOS005250859 | 526.563 | C28 H22 N4 O5 S | WLDIFXPTBNLWEM-XQNSMLJCSA-N | InChI=1S/C28H22N4O5S/c1-18-8-10-19(11-9-18)16-23-26(34)31(20-6-4-3-5-7-20)28(29-23)38-17-24(33)25-27(35)37-30-32(25)21-12-14-22(36-2)15-13-21/h3-16H,17H2,1-2H3/b23-16+ | Cc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])c5ccccc5 | |
| AKOS005251087 | 526.563 | C28 H22 N4 O5 S | FDZCWNKXRDGHMY-XQNSMLJCSA-N | InChI=1S/C28H22N4O5S/c1-31-25(27(35)37-30-31)24(33)18-38-28-29-23(26(34)32(28)21-10-6-3-7-11-21)16-19-12-14-22(15-13-19)36-17-20-8-4-2-5-9-20/h2-16H,17-18H2,1H3/b23-16+ | C[n+]1c(c(on1)[O-])C(=O)CSC2=N/C(=C/c3ccc(cc3)OCc4ccccc4)/C(=O)N2c5ccccc5 | |
| AKOS005250426 | 542.562 | C28 H22 N4 O6 S | RTFWLLZNXFEZBW-XQNSMLJCSA-N | InChI=1S/C28H22N4O6S/c1-36-21-12-8-18(9-13-21)16-23-26(34)31(19-6-4-3-5-7-19)28(29-23)39-17-24(33)25-27(35)38-30-32(25)20-10-14-22(37-2)15-11-20/h3-16H,17H2,1-2H3/b23-16+ | COc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])c5ccccc5 | |
| AKOS005250825 | 542.562 | C28 H22 N4 O6 S | NUMYJFDMXBOLGX-CJLVFECKSA-N | InChI=1S/C28H22N4O6S/c1-36-21-13-14-24(37-2)18(15-21)16-22-26(34)31(19-9-5-3-6-10-19)28(29-22)39-17-23(33)25-27(35)38-30-32(25)20-11-7-4-8-12-20/h3-16H,17H2,1-2H3/b22-16+ | COc1ccc(c(c1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5)OC | |
| AKOS005250831 | 542.562 | C28 H22 N4 O6 S | YFIGBABOPYCBCO-LTGZKZEYSA-N | InChI=1S/C28H22N4O6S/c1-36-23-15-9-10-18(25(23)37-2)16-21-26(34)31(19-11-5-3-6-12-19)28(29-21)39-17-22(33)24-27(35)38-30-32(24)20-13-7-4-8-14-20/h3-16H,17H2,1-2H3/b21-16+ | COc1cccc(c1OC)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005250841 | 542.562 | C28 H22 N4 O6 S | FODLBJLMWNUNKT-RCCKNPSSSA-N | InChI=1S/C28H22N4O6S/c1-36-23-14-13-18(16-24(23)37-2)15-21-26(34)31(19-9-5-3-6-10-19)28(29-21)39-17-22(33)25-27(35)38-30-32(25)20-11-7-4-8-12-20/h3-16H,17H2,1-2H3/b21-15+ | COc1ccc(cc1OC)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005250846 | 542.562 | C28 H22 N4 O6 S | QAEKKDCFTPENKK-PXLXIMEGSA-N | InChI=1S/C28H22N4O6S/c1-36-21-14-13-18(24(16-21)37-2)15-22-26(34)31(19-9-5-3-6-10-19)28(29-22)39-17-23(33)25-27(35)38-30-32(25)20-11-7-4-8-12-20/h3-16H,17H2,1-2H3/b22-15+ | COc1ccc(c(c1)OC)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005250852 | 542.562 | C28 H22 N4 O6 S | VVJPDSCVDRKRSD-CJLVFECKSA-N | InChI=1S/C28H22N4O6S/c1-36-21-14-12-20(13-15-21)32-25(27(35)38-30-32)23(33)17-39-28-29-22(16-18-8-6-7-11-24(18)37-2)26(34)31(28)19-9-4-3-5-10-19/h3-16H,17H2,1-2H3/b22-16+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccccc4OC)/C(=O)N3c5ccccc5 | |
| AKOS005250856 | 542.562 | C28 H22 N4 O6 S | MJNHWXZXMDQUNJ-XQNSMLJCSA-N | InChI=1S/C28H22N4O6S/c1-36-21-13-11-20(12-14-21)32-25(27(35)38-30-32)24(33)17-39-28-29-23(16-18-7-6-10-22(15-18)37-2)26(34)31(28)19-8-4-3-5-9-19/h3-16H,17H2,1-2H3/b23-16+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4cccc(c4)OC)/C(=O)N3c5ccccc5 | |
| AKOS005253926 | 554.576 | C28 H22 N6 O5 S | GEVYFZBUZLVDGA-UHFFFAOYSA-N | InChI=1S/C28H22N6O5S/c1-32-22(27(37)39-31-32)16-33-21(26(36)34(28(33)40)19-7-3-2-4-8-19)15-24(35)29-18-13-11-17(12-14-18)25-30-20-9-5-6-10-23(20)38-25/h2-14,21H,15-16H2,1H3,(H-,29,30,31,35,37) | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)c3ccccc3)CC(=O)Nc4ccc(cc4)c5nc6ccccc6o5 | |
| AKOS005253953 | 619.489 | C28 H23 Br N6 O4 S | HGDJPDKGRUNWCT-UHFFFAOYSA-N | InChI=1S/C28H23BrN6O4S/c1-33-23(26(39-32-33)31-25(37)18-8-4-2-5-9-18)17-34-22(16-24(36)30-20-14-12-19(29)13-15-20)27(38)35(28(34)40)21-10-6-3-7-11-21/h2-15,22H,16-17H2,1H3,(H-,30,31,32,36,37) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)Br | |
| AKOS005253957 | 575.038 | C28 H23 Cl N6 O4 S | PCPIYERWIHSOME-UHFFFAOYSA-N | InChI=1S/C28H23ClN6O4S/c1-33-23(26(39-32-33)31-25(37)18-8-4-2-5-9-18)17-34-22(16-24(36)30-20-14-12-19(29)13-15-20)27(38)35(28(34)40)21-10-6-3-7-11-21/h2-15,22H,16-17H2,1H3,(H-,30,31,32,36,37) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)Cl | |
| AKOS005253955 | 558.583 | C28 H23 F N6 O4 S | QVXGWWUMBAMAFH-UHFFFAOYSA-N | InChI=1S/C28H23FN6O4S/c1-33-23(26(39-32-33)31-25(37)18-8-4-2-5-9-18)17-34-22(16-24(36)30-20-14-12-19(29)13-15-20)27(38)35(28(34)40)21-10-6-3-7-11-21/h2-15,22H,16-17H2,1H3,(H-,30,31,32,36,37) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)F | |
| AKOS005253954 | 666.489 | C28 H23 I N6 O4 S | FQGBCQISWLLRTK-UHFFFAOYSA-N | InChI=1S/C28H23IN6O4S/c1-33-23(26(39-32-33)31-25(37)18-8-4-2-5-9-18)17-34-22(16-24(36)30-20-14-12-19(29)13-15-20)27(38)35(28(34)40)21-10-6-3-7-11-21/h2-15,22H,16-17H2,1H3,(H-,30,31,32,36,37) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)I | |
| AKOS005251016 | 493.513 | C28 H23 N5 O4 | ONGNZQCFGBAIQS-UHFFFAOYSA-O | InChI=1S/C28H22N5O4/c34-26(19-9-3-1-4-10-19)31-24(17-25-28(36)37-32-33(25)21-11-5-2-6-12-21)27(35)29-16-15-20-18-30-23-14-8-7-13-22(20)23/h1-14,17-18,30H,15-16H2,(H,29,35)/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)NCCc4c[nH]c5c4cccc5 | |
| AKOS005250809 | 525.578 | C28 H23 N5 O4 S | DVPWCVBRHSUECH-HAVVHWLPSA-N | InChI=1S/C28H23N5O4S/c1-31(2)20-15-13-19(14-16-20)17-23-26(35)32(21-9-5-3-6-10-21)28(29-23)38-18-24(34)25-27(36)37-30-33(25)22-11-7-4-8-12-22/h3-17H,18H2,1-2H3/b23-17+ | CN(C)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005252451 | 525.578 | C28 H23 N5 O4 S | HCHGJZZHAQETMX-LFVJCYFKSA-N | InChI=1S/C28H23N5O4S/c1-32-17-26(37-31-32)30-25(34)19-38-28-29-24(27(35)33(28)22-10-6-3-7-11-22)16-20-12-14-23(15-13-20)36-18-21-8-4-2-5-9-21/h2-17H,18-19H2,1H3/b24-16+ | C[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)OCc4ccccc4)/C(=O)N2c5ccccc5 | |
| AKOS005253179 | 541.578 | C28 H23 N5 O5 S | DBFHMPJPWQSXLP-UHFFFAOYSA-N | InChI=1S/C28H23N5O5S/c1-16-3-12-21-24(13-16)39-26(30-21)17-4-6-18(7-5-17)32-25(34)14-22(27(32)35)29-15-23-28(36)38-31-33(23)19-8-10-20(37-2)11-9-19/h3-13,22,29H,14-15H2,1-2H3 | Cc1ccc2c(c1)sc(n2)c3ccc(cc3)N4C(=O)CC(C4=O)NCc5c(on[n+]5c6ccc(cc6)OC)[O-] | |
| AKOS005251326 | 525.512 | C28 H23 N5 O6 | AECVESTYJNMDRB-UHFFFAOYSA-N | InChI=1S/C28H23N5O6/c1-31(16-23-28(36)39-30-33(23)19-11-13-20(37-2)14-12-19)22-15-25(34)32(27(22)35)18-9-7-17(8-10-18)26-29-21-5-3-4-6-24(21)38-26/h3-14,22H,15-16H2,1-2H3 | CN(Cc1c(on[n+]1c2ccc(cc2)OC)[O-])C3CC(=O)N(C3=O)c4ccc(cc4)c5nc6ccccc6o5 | |
| AKOS005253633 | 525.512 | C28 H23 N5 O6 | CTRGBSUXZZCDQC-UHFFFAOYSA-N | InChI=1S/C28H23N5O6/c34-25(29-19-12-10-18(11-13-19)26-30-21-8-4-5-9-23(21)38-26)16-24-27(35)32(14-15-37-24)17-22-28(36)39-31-33(22)20-6-2-1-3-7-20/h1-13,24H,14-17H2,(H-,29,30,31,34,36) | c1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)c5nc6ccccc6o5 | |
| AKOS005253944 | 585.591 | C28 H23 N7 O6 S | UKMXNDGYTWHANM-UHFFFAOYSA-N | InChI=1S/C28H23N7O6S/c1-32-23(26(41-31-32)30-25(37)18-8-4-2-5-9-18)17-33-22(27(38)34(28(33)42)20-10-6-3-7-11-20)16-24(36)29-19-12-14-21(15-13-19)35(39)40/h2-15,22H,16-17H2,1H3,(H-,29,30,31,36,37) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)N(=O)=O | |
| AKOS005251056 | 513.52 | C28 H24 F N5 O4 | TWZPCRUXHZPJPN-UHFFFAOYSA-O | InChI=1S/C28H23FN5O4/c29-22-13-7-8-14-24(22)32-15-17-33(18-16-32)27(36)23(30-26(35)20-9-3-1-4-10-20)19-25-28(37)38-31-34(25)21-11-5-2-6-12-21/h1-14,19H,15-18H2/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CCN(CC4)c5ccccc5F | |
| AKOS005251062 | 513.52 | C28 H24 F N5 O4 | ABZWZIVZVIRYQW-UHFFFAOYSA-O | InChI=1S/C28H23FN5O4/c29-21-11-13-22(14-12-21)32-15-17-33(18-16-32)27(36)24(30-26(35)20-7-3-1-4-8-20)19-25-28(37)38-31-34(25)23-9-5-2-6-10-23/h1-14,19H,15-18H2/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CCN(CC4)c5ccc(cc5)F | |
| AKOS005250886 | 496.514 | C28 H24 N4 O5 | BLBAVYYNCCEIBF-UHFFFAOYSA-O | InChI=1S/C28H23N4O5/c1-36-23-13-11-22(12-14-23)32-25(28(35)37-30-32)17-24(29-26(33)20-8-3-2-4-9-20)27(34)31-16-15-19-7-5-6-10-21(19)18-31/h2-14,17H,15-16,18H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCc4ccccc4C3)\NC(=O)c5ccccc5 | |
| AKOS005253177 | 496.514 | C28 H24 N4 O5 | ULHFUOWTUUOXQT-BQYQJAHWSA-N | InChI=1S/C28H24N4O5/c1-36-23-15-13-22(14-16-23)32-25(28(35)37-30-32)18-29-24-17-26(33)31(27(24)34)21-11-9-20(10-12-21)8-7-19-5-3-2-4-6-19/h2-16,24,29H,17-18H2,1H3/b8-7+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])CNC3CC(=O)N(C3=O)c4ccc(cc4)/C=C/c5ccccc5 | |
| AKOS005253708 | 528.579 | C28 H24 N4 O5 S | QUHCAYNZZZEABW-UHFFFAOYSA-N | InChI=1S/C28H24N4O5S/c1-5-16-6-8-17(9-7-16)21-20(15(3)33)14(2)30-27-22(21)23(29)26(38-27)25(34)24-28(35)37-31-32(24)18-10-12-19(36-4)13-11-18/h6-13H,5H2,1-4H3,(H2-,29,31,34,35) | CCc1ccc(cc1)c2c3c(c(sc3nc(c2C(=O)C)C)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N | |
| AKOS005253780 | 560.578 | C28 H24 N4 O7 S | VDVIIBMFESAWRR-UHFFFAOYSA-N | InChI=1S/C28H24N4O7S/c1-13-19(14(2)33)20(15-11-17(36-3)25(38-5)18(12-15)37-4)21-22(29)26(40-27(21)30-13)24(34)23-28(35)39-31-32(23)16-9-7-6-8-10-16/h6-12H,1-5H3,(H2-,29,31,34,35) | Cc1c(c(c2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccccc4)[O-])N)c5cc(c(c(c5)OC)OC)OC)C(=O)C | |
| AKOS005251255 | 508.528 | C28 H24 N6 O4 | HUNMJPDYLVXJFQ-QVIHXGFCSA-N | InChI=1S/C28H24N6O4/c35-26-17-24(27(36)33(26)22-13-11-20(12-14-22)30-29-19-7-3-1-4-8-19)32(21-15-16-21)18-25-28(37)38-31-34(25)23-9-5-2-6-10-23/h1-14,21,24H,15-18H2/b30-29+ | c1ccc(cc1)/N=N/c2ccc(cc2)N3C(=O)CC(C3=O)N(Cc4c(on[n+]4c5ccccc5)[O-])C6CC6 | |
| AKOS005253020 | 540.593 | C28 H24 N6 O4 S | PEVZJNOVUGKSFC-JJIBRWJFSA-N | InChI=1S/C28H24N6O4S/c35-25(30-26-18-33(31-38-26)32-13-15-37-16-14-32)19-39-28-29-24(27(36)34(28)22-10-2-1-3-11-22)17-21-9-6-8-20-7-4-5-12-23(20)21/h1-12,17-18H,13-16,19H2/b24-17+ | c1ccc(cc1)N2C(=O)/C(=C\c3cccc4c3cccc4)/N=C2SCC(=O)[N-]c5c[n+](no5)N6CCOCC6 | |
| AKOS005253939 | 540.593 | C28 H24 N6 O4 S | MQETWBQUVONIGP-UHFFFAOYSA-N | InChI=1S/C28H24N6O4S/c1-32-23(26(38-31-32)30-25(36)19-11-5-2-6-12-19)18-33-22(17-24(35)29-20-13-7-3-8-14-20)27(37)34(28(33)39)21-15-9-4-10-16-21/h2-16,22H,17-18H2,1H3,(H-,29,30,31,35,36) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccccc5 | |
| AKOS005251019 | 540.527 | C28 H24 N6 O6 | CAELCEYMCNSVOT-UHFFFAOYSA-O | InChI=1S/C28H23N6O6/c35-26(20-7-3-1-4-8-20)29-24(19-25-28(37)40-30-33(25)22-9-5-2-6-10-22)27(36)32-17-15-31(16-18-32)21-11-13-23(14-12-21)34(38)39/h1-14,19H,15-18H2/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CCN(CC4)c5ccc(cc5)[N+](=O)[O-] | |
| AKOS005253853 | 540.527 | C28 H24 N6 O6 | CAELCEYMCNSVOT-UHFFFAOYSA-O | InChI=1S/C28H23N6O6/c35-26(20-7-3-1-4-8-20)29-24(19-25-28(37)40-30-33(25)22-9-5-2-6-10-22)27(36)32-17-15-31(16-18-32)21-11-13-23(14-12-21)34(38)39/h1-14,19H,15-18H2/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CCN(CC4)c5ccc(cc5)N(=O)=O | |
| AKOS005254151 | 669.569 | C28 H25 Br N6 O5 S2 | VZBQSHFRTYPHQQ-UHFFFAOYSA-N | InChI=1S/C28H25BrN6O5S2/c1-18-8-14-22(15-9-18)42(38,39)31-26-24(33(2)32-40-26)17-34-23(16-25(36)30-20-12-10-19(29)11-13-20)27(37)35(28(34)41)21-6-4-3-5-7-21/h3-15,23H,16-17H2,1-2H3,(H-,30,31,32,36) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)Br | |
| AKOS005254150 | 625.118 | C28 H25 Cl N6 O5 S2 | YFTFKSLGXQYALJ-UHFFFAOYSA-N | InChI=1S/C28H25ClN6O5S2/c1-18-8-14-22(15-9-18)42(38,39)31-26-24(33(2)32-40-26)17-34-23(16-25(36)30-20-12-10-19(29)11-13-20)27(37)35(28(34)41)21-6-4-3-5-7-21/h3-15,23H,16-17H2,1-2H3,(H-,30,31,32,36) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)Cl | |
| AKOS005254153 | 608.664 | C28 H25 F N6 O5 S2 | JXZUULNWUTUUEU-UHFFFAOYSA-N | InChI=1S/C28H25FN6O5S2/c1-18-8-14-22(15-9-18)42(38,39)31-26-24(33(2)32-40-26)17-34-23(16-25(36)30-20-12-10-19(29)11-13-20)27(37)35(28(34)41)21-6-4-3-5-7-21/h3-15,23H,16-17H2,1-2H3,(H-,30,31,32,36) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)F | |
| AKOS005254152 | 716.57 | C28 H25 I N6 O5 S2 | JNMZTLVBZYSEGO-UHFFFAOYSA-N | InChI=1S/C28H25IN6O5S2/c1-18-8-14-22(15-9-18)42(38,39)31-26-24(33(2)32-40-26)17-34-23(16-25(36)30-20-12-10-19(29)11-13-20)27(37)35(28(34)41)21-6-4-3-5-7-21/h3-15,23H,16-17H2,1-2H3,(H-,30,31,32,36) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)I | |
| AKOS005251049 | 495.529 | C28 H25 N5 O4 | MNNANMVTDKPSFV-UHFFFAOYSA-O | InChI=1S/C28H24N5O4/c34-26(21-10-4-1-5-11-21)29-24(20-25-28(36)37-30-33(25)23-14-8-3-9-15-23)27(35)32-18-16-31(17-19-32)22-12-6-2-7-13-22/h1-15,20H,16-19H2/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CCN(CC4)c5ccccc5 | |
| AKOS005250914 | 543.527 | C28 H25 N5 O7 | UKUSWGDKHXJJAE-UHFFFAOYSA-O | InChI=1S/C28H24N5O7/c1-38-21-11-9-20(10-12-21)33-23(28(37)40-30-33)18-22(29-25(34)19-6-3-2-4-7-19)26(35)31-13-15-32(16-14-31)27(36)24-8-5-17-39-24/h2-12,17-18H,13-16H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCN(CC3)C(=O)c4ccco4)\NC(=O)c5ccccc5 | |
| AKOS005253956 | 619.671 | C28 H25 N7 O6 S2 | ZUPNTRWHFGJICE-UHFFFAOYSA-N | InChI=1S/C28H25N7O6S2/c1-33-23(26(41-32-33)31-25(37)18-8-4-2-5-9-18)17-34-22(27(38)35(28(34)42)20-10-6-3-7-11-20)16-24(36)30-19-12-14-21(15-13-19)43(29,39)40/h2-15,22H,16-17H2,1H3,(H3-,29,30,31,32,36,37,39,40) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)S(=O)(=O)N | |
| AKOS005254141 | 635.671 | C28 H25 N7 O7 S2 | ULODDRMFEPPTTJ-UHFFFAOYSA-N | InChI=1S/C28H25N7O7S2/c1-18-8-14-22(15-9-18)44(40,41)30-26-24(32(2)31-42-26)17-33-23(27(37)34(28(33)43)20-6-4-3-5-7-20)16-25(36)29-19-10-12-21(13-11-19)35(38)39/h3-15,23H,16-17H2,1-2H3,(H-,29,30,31,36) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)N(=O)=O | |
| AKOS005252391 | 546.66 | C28 H26 N4 O4 S2 | CODKDMDCDDIJEC-UHFFFAOYSA-N | InChI=1S/C28H26N4O4S2/c1-3-23(38-27-28(34)36-31-32(27)19-10-12-20(35-2)13-11-19)25(33)30-26-22(16-29)21-14-9-18(15-24(21)37-26)17-7-5-4-6-8-17/h4-8,10-13,18,23H,3,9,14-15H2,1-2H3,(H-,30,31,33,34) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)c3ccccc3)C#N)Sc4c(on[n+]4c5ccc(cc5)OC)[O-] | |
| AKOS005251000 | 514.529 | C28 H26 N4 O6 | GZRXSKJWJCQQRL-UHFFFAOYSA-O | InChI=1S/C28H25N4O6/c1-36-22-12-8-19(9-13-22)16-17-29-27(34)24(30-26(33)20-6-4-3-5-7-20)18-25-28(35)38-31-32(25)21-10-14-23(37-2)15-11-21/h3-15,18H,16-17H2,1-2H3,(H,29,34)/q-1/p+1 | COc1ccc(cc1)CCNC(=O)/C(=C/c2c(on[n+]2c3ccc(cc3)OC)[O-])/NC(=O)c4ccccc4 | |
| AKOS005251006 | 514.529 | C28 H26 N4 O6 | FNXYFZHBOVSSPD-UHFFFAOYSA-O | InChI=1S/C28H25N4O6/c1-36-22-14-12-21(13-15-22)32-24(28(35)38-31-32)18-23(30-26(33)20-9-4-3-5-10-20)27(34)29-17-16-19-8-6-7-11-25(19)37-2/h3-15,18H,16-17H2,1-2H3,(H,29,34)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCCc3ccccc3OC)\NC(=O)c4ccccc4 | |
| AKOS005251044 | 514.529 | C28 H26 N4 O6 | RZCCUSGKVQMFOV-UHFFFAOYSA-O | InChI=1S/C28H25N4O6/c1-36-24-14-13-19(17-25(24)37-2)15-16-29-27(34)22(30-26(33)20-9-5-3-6-10-20)18-23-28(35)38-31-32(23)21-11-7-4-8-12-21/h3-14,17-18H,15-16H2,1-2H3,(H,29,34)/q-1/p+1 | COc1ccc(cc1OC)CCNC(=O)/C(=C/c2c(on[n+]2c3ccccc3)[O-])/NC(=O)c4ccccc4 | |
| AKOS005253061 | 510.61 | C28 H26 N6 O2 S | MSIPQJZPLKQBGE-UHFFFAOYSA-N | InChI=1S/C28H26N6O2S/c1-20-10-12-21(13-11-20)23-16-25(22-8-4-2-5-9-22)30-28(24(23)17-29)37-19-26(35)31-27-18-34(32-36-27)33-14-6-3-7-15-33/h2,4-5,8-13,16,18H,3,6-7,14-15,19H2,1H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005253065 | 526.609 | C28 H26 N6 O3 S | ZIWIEPGNFMRLOH-UHFFFAOYSA-N | InChI=1S/C28H26N6O3S/c1-36-22-12-10-20(11-13-22)23-16-25(21-8-4-2-5-9-21)30-28(24(23)17-29)38-19-26(35)31-27-18-34(32-37-27)33-14-6-3-7-15-33/h2,4-5,8-13,16,18H,3,6-7,14-15,19H2,1H3 | COc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005252992 | 542.609 | C28 H26 N6 O4 S | IKFLUJLNZSCKRP-UHFFFAOYSA-N | InChI=1S/C28H26N6O4S/c1-19-3-5-20(6-4-19)23-15-25(21-7-9-22(36-2)10-8-21)30-28(24(23)16-29)39-18-26(35)31-27-17-34(32-38-27)33-11-13-37-14-12-33/h3-10,15,17H,11-14,18H2,1-2H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccc(cc5)OC | |
| AKOS005250873 | 526.543 | C28 H26 N6 O5 | OEQHIMRLHDQMSZ-UHFFFAOYSA-O | InChI=1S/C28H25N6O5/c1-38-22-12-10-21(11-13-22)34-24(28(37)39-31-34)19-23(30-26(35)20-7-3-2-4-8-20)27(36)33-17-15-32(16-18-33)25-9-5-6-14-29-25/h2-14,19H,15-18H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCN(CC3)c4ccccn4)\NC(=O)c5ccccc5 | |
| AKOS005252982 | 558.608 | C28 H26 N6 O5 S | IUDWTTORPDWINN-UHFFFAOYSA-N | InChI=1S/C28H26N6O5S/c1-36-24-10-6-9-20(27(24)37-2)21-15-23(19-7-4-3-5-8-19)30-28(22(21)16-29)40-18-25(35)31-26-17-34(32-39-26)33-11-13-38-14-12-33/h3-10,15,17H,11-14,18H2,1-2H3 | COc1cccc(c1OC)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005253010 | 558.608 | C28 H26 N6 O5 S | KDOBJJCJUZKQMU-UHFFFAOYSA-N | InChI=1S/C28H26N6O5S/c1-36-20-8-9-25(37-2)22(14-20)21-15-24(19-6-4-3-5-7-19)30-28(23(21)16-29)40-18-26(35)31-27-17-34(32-39-27)33-10-12-38-13-11-33/h3-9,14-15,17H,10-13,18H2,1-2H3 | COc1ccc(c(c1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5)OC | |
| AKOS005254136 | 590.673 | C28 H26 N6 O5 S2 | HNCJDKMNQZVWQA-UHFFFAOYSA-N | InChI=1S/C28H26N6O5S2/c1-19-13-15-22(16-14-19)41(37,38)30-26-24(32(2)31-39-26)18-33-23(17-25(35)29-20-9-5-3-6-10-20)27(36)34(28(33)40)21-11-7-4-8-12-21/h3-16,23H,17-18H2,1-2H3,(H-,29,30,31,35) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccccc5 | |
| AKOS005251661 | 549.661 | C28 H27 N3 O5 S2 | BGEUDLCWBMNTRD-UHFFFAOYSA-N | InChI=1S/C28H27N3O5S2/c1-3-35-27(33)23-21-15-14-19(18-10-6-4-7-11-18)16-22(21)38-25(23)29-24(32)17(2)37-26-28(34)36-30-31(26)20-12-8-5-9-13-20/h4-13,17,19H,3,14-16H2,1-2H3,(H-,29,30,32,33,34) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccccc4)[O-])CC(CC2)c5ccccc5 | |
| AKOS005251963 | 549.661 | C28 H27 N3 O5 S2 | FCXQLRPPGZQYSW-UHFFFAOYSA-N | InChI=1S/C28H27N3O5S2/c1-3-21(38-26-28(34)36-30-31(26)19-12-8-5-9-13-19)24(32)29-25-23(27(33)35-2)20-15-14-18(16-22(20)37-25)17-10-6-4-7-11-17/h4-13,18,21H,3,14-16H2,1-2H3,(H-,29,30,32,33,34) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)c3ccccc3)C(=O)OC)Sc4c(on[n+]4c5ccccc5)[O-] | |
| AKOS005252554 | 549.661 | C28 H27 N3 O5 S2 | KPCMCDSYAFDRIH-UHFFFAOYSA-N | InChI=1S/C28H27N3O5S2/c1-2-35-27(33)24-21-14-13-19(18-9-5-3-6-10-18)17-22(21)38-25(24)29-23(32)15-16-37-26-28(34)36-30-31(26)20-11-7-4-8-12-20/h3-12,19H,2,13-17H2,1H3,(H-,29,30,32,33,34) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])CC(CC2)c5ccccc5 | |
| AKOS005251517 | 565.66 | C28 H27 N3 O6 S2 | TZJGFKLQSXGKED-UHFFFAOYSA-N | InChI=1S/C28H27N3O6S2/c1-3-36-27(33)24-21-14-9-18(17-7-5-4-6-8-17)15-22(21)39-25(24)29-23(32)16-38-26-28(34)37-30-31(26)19-10-12-20(35-2)13-11-19/h4-8,10-13,18H,3,9,14-16H2,1-2H3,(H-,29,30,32,33,34) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])CC(CC2)c5ccccc5 | |
| AKOS005251727 | 565.66 | C28 H27 N3 O6 S2 | KMDXDUVRTLTLFA-UHFFFAOYSA-N | InChI=1S/C28H27N3O6S2/c1-16(38-26-28(34)37-30-31(26)19-10-12-20(35-2)13-11-19)24(32)29-25-23(27(33)36-3)21-14-9-18(15-22(21)39-25)17-7-5-4-6-8-17/h4-8,10-13,16,18H,9,14-15H2,1-3H3,(H-,29,30,32,33,34) | CC(C(=O)Nc1c(c2c(s1)CC(CC2)c3ccccc3)C(=O)OC)Sc4c(on[n+]4c5ccc(cc5)OC)[O-] | |
| AKOS005252580 | 565.66 | C28 H27 N3 O6 S2 | SIOBNXMTRIYUDB-UHFFFAOYSA-N | InChI=1S/C28H27N3O6S2/c1-35-20-11-9-19(10-12-20)31-26(28(34)37-30-31)38-15-14-23(32)29-25-24(27(33)36-2)21-13-8-18(16-22(21)39-25)17-6-4-3-5-7-17/h3-7,9-12,18H,8,13-16H2,1-2H3,(H-,29,30,32,33,34) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3c(c4c(s3)CC(CC4)c5ccccc5)C(=O)OC | |
| AKOS005252400 | 561.675 | C28 H27 N5 O4 S2 | YFFRQFQSWVOXHV-UHFFFAOYSA-N | InChI=1S/C28H27N5O4S2/c1-3-23(39-27-28(35)37-31-33(27)19-9-11-20(36-2)12-10-19)25(34)30-26-22(15-29)21-13-14-32(17-24(21)38-26)16-18-7-5-4-6-8-18/h4-12,23H,3,13-14,16-17H2,1-2H3,(H-,30,31,34,35) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)Cc3ccccc3)C#N)Sc4c(on[n+]4c5ccc(cc5)OC)[O-] | |
| AKOS005252894 | 545.609 | C28 H27 N5 O5 S | IABNJFJOFSINLN-UHFFFAOYSA-N | InChI=1S/C28H27N5O5S/c1-17(2)33-15-26(38-32-33)31-25(34)16-39-28-21(14-29)20(13-22(30-28)18-9-7-6-8-10-18)19-11-23(35-3)27(37-5)24(12-19)36-4/h6-13,15,17H,16H2,1-5H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cc(c(c(c4)OC)OC)OC)C#N | |
| AKOS005253299 | 561.609 | C28 H27 N5 O6 S | IZHXHVZUJPWXTJ-UHFFFAOYSA-N | InChI=1S/C28H27N5O6S/c1-35-11-10-33-16-26(39-32-33)31-25(34)17-40-28-21(15-29)20(14-22(30-28)18-8-6-5-7-9-18)19-12-23(36-2)27(38-4)24(13-19)37-3/h5-9,12-14,16H,10-11,17H2,1-4H3 | COCC[n+]1cc(on1)[N-]C(=O)CSc2c(c(cc(n2)c3ccccc3)c4cc(c(c(c4)OC)OC)OC)C#N | |
| AKOS005254154 | 669.752 | C28 H27 N7 O7 S3 | KXXHTXKOVGGLGU-UHFFFAOYSA-N | InChI=1S/C28H27N7O7S3/c1-18-8-12-22(13-9-18)45(40,41)31-26-24(33(2)32-42-26)17-34-23(27(37)35(28(34)43)20-6-4-3-5-7-20)16-25(36)30-19-10-14-21(15-11-19)44(29,38)39/h3-15,23H,16-17H2,1-2H3,(H3-,29,30,31,32,36,38,39) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)S(=O)(=O)N | |
| AKOS005251667 | 564.676 | C28 H28 N4 O5 S2 | SGTCLYPIYQDDGK-UHFFFAOYSA-N | InChI=1S/C28H28N4O5S2/c1-3-36-27(34)23-21-14-15-31(16-19-10-6-4-7-11-19)17-22(21)39-25(23)29-24(33)18(2)38-26-28(35)37-30-32(26)20-12-8-5-9-13-20/h4-13,18H,3,14-17H2,1-2H3,(H-,29,30,33,34,35) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccccc4)[O-])CN(CC2)Cc5ccccc5 | |
| AKOS005251978 | 564.676 | C28 H28 N4 O5 S2 | MOUOZSJPWLACRI-UHFFFAOYSA-N | InChI=1S/C28H28N4O5S2/c1-3-21(39-26-28(35)37-30-32(26)19-12-8-5-9-13-19)24(33)29-25-23(27(34)36-2)20-14-15-31(17-22(20)38-25)16-18-10-6-4-7-11-18/h4-13,21H,3,14-17H2,1-2H3,(H-,29,30,33,34,35) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)Cc3ccccc3)C(=O)OC)Sc4c(on[n+]4c5ccccc5)[O-] | |
| AKOS005252560 | 564.676 | C28 H28 N4 O5 S2 | QWOKEHZUWNPOHS-UHFFFAOYSA-N | InChI=1S/C28H28N4O5S2/c1-2-36-27(34)24-21-13-15-31(17-19-9-5-3-6-10-19)18-22(21)39-25(24)29-23(33)14-16-38-26-28(35)37-30-32(26)20-11-7-4-8-12-20/h3-12H,2,13-18H2,1H3,(H-,29,30,33,34,35) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccccc4)[O-])CN(CC2)Cc5ccccc5 | |
| AKOS005251519 | 580.675 | C28 H28 N4 O6 S2 | NJDMJPLTTNTLAS-UHFFFAOYSA-N | InChI=1S/C28H28N4O6S2/c1-3-37-27(34)24-21-13-14-31(15-18-7-5-4-6-8-18)16-22(21)40-25(24)29-23(33)17-39-26-28(35)38-30-32(26)19-9-11-20(36-2)12-10-19/h4-12H,3,13-17H2,1-2H3,(H-,29,30,33,34,35) | CCOC(=O)c1c2c(sc1NC(=O)CSc3c(on[n+]3c4ccc(cc4)OC)[O-])CN(CC2)Cc5ccccc5 | |
| AKOS005251692 | 580.675 | C28 H28 N4 O6 S2 | HOTVQTHICJVEPO-UHFFFAOYSA-N | InChI=1S/C28H28N4O6S2/c1-17(39-26-28(35)38-30-32(26)19-9-11-20(36-2)12-10-19)24(33)29-25-23(27(34)37-3)21-13-14-31(16-22(21)40-25)15-18-7-5-4-6-8-18/h4-12,17H,13-16H2,1-3H3,(H-,29,30,33,34,35) | CC(C(=O)Nc1c(c2c(s1)CN(CC2)Cc3ccccc3)C(=O)OC)Sc4c(on[n+]4c5ccc(cc5)OC)[O-] | |
| AKOS005252615 | 580.675 | C28 H28 N4 O6 S2 | ZKHXXNWGWAZQPW-UHFFFAOYSA-N | InChI=1S/C28H28N4O6S2/c1-36-20-10-8-19(9-11-20)32-26(28(35)38-30-32)39-15-13-23(33)29-25-24(27(34)37-2)21-12-14-31(17-22(21)40-25)16-18-6-4-3-5-7-18/h3-11H,12-17H2,1-2H3,(H-,29,30,33,34,35) | COc1ccc(cc1)[n+]2c(c(on2)[O-])SCCC(=O)Nc3c(c4c(s3)CN(CC4)Cc5ccccc5)C(=O)OC | |
| AKOS005252279 | 596.675 | C28 H28 N4 O7 S2 | CMZDMCRMBQLTBY-UHFFFAOYSA-N | InChI=1S/C28H28N4O7S2/c1-5-20(40-26-28(36)39-31-32(26)18-12-14-19(37-4)15-13-18)23(33)30-25-21(27(35)38-6-2)16(3)22(41-25)24(34)29-17-10-8-7-9-11-17/h7-15,20H,5-6H2,1-4H3,(H2-,29,30,31,33,34,35,36) | CCC(C(=O)Nc1c(c(c(s1)C(=O)Nc2ccccc2)C)C(=O)OCC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005253962 | 576.624 | C28 H28 N6 O6 S | YZXAKQURIQKEAC-UHFFFAOYSA-N | InChI=1S/C28H28N6O6S/c1-3-39-27(38)18-9-11-19(12-10-18)29-23(35)15-21-26(37)34(20-13-14-20)28(41)33(21)16-22-25(40-31-32(22)2)30-24(36)17-7-5-4-6-8-17/h4-12,20-21H,3,13-16H2,1-2H3,(H-,29,30,31,35,36,38) | CCOC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)C5CC5 | |
| AKOS005253128 | 530.641 | C28 H30 N6 O3 S | BLIYLJCKZQSFDI-JJIBRWJFSA-N | InChI=1S/C28H30N6O3S/c1-20(2)22-13-11-21(12-14-22)17-24-27(36)34(23-9-5-3-6-10-23)28(29-24)38-19-25(35)30-26-18-33(31-37-26)32-15-7-4-8-16-32/h3,5-6,9-14,17-18,20H,4,7-8,15-16,19H2,1-2H3/b24-17+ | CC(C)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005253100 | 578.639 | C28 H30 N6 O6 S | OHHSBGCDOLSKTE-KGENOOAVSA-N | InChI=1S/C28H30N6O6S/c1-37-22-16-24(39-3)23(38-2)15-19(22)14-21-27(36)34(20-10-6-4-7-11-20)28(29-21)41-18-25(35)30-26-17-33(31-40-26)32-12-8-5-9-13-32/h4,6-7,10-11,14-17H,5,8-9,12-13,18H2,1-3H3/b21-14+ | COc1cc(c(cc1OC)OC)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005253105 | 578.639 | C28 H30 N6 O6 S | WLCMXLSSQJJFNY-KGENOOAVSA-N | InChI=1S/C28H30N6O6S/c1-37-22-15-19(16-23(38-2)26(22)39-3)14-21-27(36)34(20-10-6-4-7-11-20)28(29-21)41-18-24(35)30-25-17-33(31-40-25)32-12-8-5-9-13-32/h4,6-7,10-11,14-17H,5,8-9,12-13,18H2,1-3H3/b21-14+ | COc1cc(cc(c1OC)OC)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005254164 | 626.704 | C28 H30 N6 O7 S2 | FLKYQBBQGAOOFJ-UHFFFAOYSA-N | InChI=1S/C28H30N6O7S2/c1-4-40-27(37)18-7-9-19(10-8-18)29-24(35)15-22-26(36)34(20-11-12-20)28(42)33(22)16-23-25(41-31-32(23)3)30-43(38,39)21-13-5-17(2)6-14-21/h5-10,13-14,20,22H,4,11-12,15-16H2,1-3H3,(H-,29,30,31,35,37) | CCOC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)C5CC5 | |
| AKOS005250881 | 549.575 | C28 H31 N5 O7 | JZLGMMCEDRCUQC-UHFFFAOYSA-O | InChI=1S/C28H30N5O7/c1-28(2,3)39-27(37)32-16-14-31(15-17-32)25(35)22(29-24(34)19-8-6-5-7-9-19)18-23-26(36)40-30-33(23)20-10-12-21(38-4)13-11-20/h5-13,18H,14-17H2,1-4H3/q-1/p+1 | CC(C)(C)OC(=O)N1CCN(CC1)C(=O)/C(=C/c2c(on[n+]2c3ccc(cc3)OC)[O-])/NC(=O)c4ccccc4 | |
| AKOS005252989 | 561.655 | C28 H31 N7 O4 S | HNIHWAZXMDFSPX-HKOYGPOVSA-N | InChI=1S/C28H31N7O4S/c1-3-32(4-2)22-12-10-21(11-13-22)18-24-27(37)35(23-8-6-5-7-9-23)28(29-24)40-20-25(36)30-26-19-34(31-39-26)33-14-16-38-17-15-33/h5-13,18-19H,3-4,14-17,20H2,1-2H3/b24-18+ | CCN(CC)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005254098 | 599.655 | C28 H33 N5 O8 S | SLFFFKLONQZTBJ-UHFFFAOYSA-N | InChI=1S/C28H33N5O8S/c1-5-39-28(36)20-8-10-21(11-9-20)29-25(34)16-24-27(35)32(14-15-40-24)17-23-26(41-31-33(23)18(2)3)30-42(37,38)22-12-6-19(4)7-13-22/h6-13,18,24H,5,14-17H2,1-4H3,(H-,29,30,31,34,36) | CCOC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(CCO2)Cc3c(on[n+]3C(C)C)[N-]S(=O)(=O)c4ccc(cc4)C | |
| AKOS005252243 | 618.722 | C28 H34 N4 O8 S2 | NMXVMCPJADCNJR-UHFFFAOYSA-N | InChI=1S/C28H34N4O8S2/c1-7-19(42-24-26(35)40-30-32(24)16-9-11-17(37-6)12-10-16)22(33)29-23-21(25(34)38-8-2)18-13-14-31(15-20(18)41-23)27(36)39-28(3,4)5/h9-12,19H,7-8,13-15H2,1-6H3,(H-,29,30,33,34,35) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)C(=O)OC(C)(C)C)C(=O)OCC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005252398 | 573.724 | C28 H35 N3 O6 S2 | ZVFBPOZILBWYDU-UHFFFAOYSA-N | InChI=1S/C28H35N3O6S2/c1-7-20(39-25-27(34)37-30-31(25)17-10-12-18(35-6)13-11-17)23(32)29-24-22(26(33)36-8-2)19-14-9-16(28(3,4)5)15-21(19)38-24/h10-13,16,20H,7-9,14-15H2,1-6H3,(H-,29,30,32,33,34) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)C(C)(C)C)C(=O)OCC)Sc3c(on[n+]3c4ccc(cc4)OC)[O-] | |
| AKOS005253743 | 592.976 | C29 H16 Cl F3 N4 O3 S | RCKUNGPBDDWQKG-UHFFFAOYSA-N | InChI=1S/C29H16ClF3N4O3S/c30-18-12-8-16(9-13-18)21-14-20(15-6-10-17(11-7-15)29(31,32)33)22-23(34)26(41-27(22)35-21)25(38)24-28(39)40-36-37(24)19-4-2-1-3-5-19/h1-14H,(H2-,34,36,38,39) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5ccc(cc5)Cl)c6ccc(cc6)C(F)(F)F)N | |
| AKOS005253778 | 590.984 | C29 H17 Cl F2 N4 O4 S | NYZWZGLPHUSOPZ-UHFFFAOYSA-N | InChI=1S/C29H17ClF2N4O4S/c1-39-18-9-7-17(8-10-18)36-25(29(38)40-35-36)26(37)27-24(33)23-20(19-11-6-16(31)12-21(19)32)13-22(34-28(23)41-27)14-2-4-15(30)5-3-14/h2-13H,1H3,(H2-,33,35,37,38) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5ccc(cc5)Cl)c6ccc(cc6F)F)N | |
| AKOS005253790 | 558.53 | C29 H17 F3 N4 O3 S | SBGYULSIBTUSBI-UHFFFAOYSA-N | InChI=1S/C29H17F3N4O3S/c30-29(31,32)18-13-11-16(12-14-18)20-15-21(17-7-3-1-4-8-17)34-27-22(20)23(33)26(40-27)25(37)24-28(38)39-35-36(24)19-9-5-2-6-10-19/h1-15H,(H2-,33,35,37,38) | c1ccc(cc1)c2cc(c3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6ccc(cc6)C(F)(F)F | |
| AKOS005254178 | 572.994 | C29 H18 Cl F N4 O4 S | JVXIRTGALODJKJ-UHFFFAOYSA-N | InChI=1S/C29H18ClFN4O4S/c1-38-20-11-9-19(10-12-20)35-25(29(37)39-34-35)26(36)27-24(32)23-21(16-3-2-4-18(31)13-16)14-22(33-28(23)40-27)15-5-7-17(30)8-6-15/h2-14H,1H3,(H2-,32,34,36,37) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5ccc(cc5)Cl)c6cccc(c6)F)N | |
| AKOS005253746 | 556.539 | C29 H18 F2 N4 O4 S | PCWQLGAPOSXAMP-UHFFFAOYSA-N | InChI=1S/C29H18F2N4O4S/c1-38-18-10-7-15(8-11-18)22-14-20(19-12-9-16(30)13-21(19)31)23-24(32)27(40-28(23)33-22)26(36)25-29(37)39-34-35(25)17-5-3-2-4-6-17/h2-14H,1H3,(H2-,32,34,36,37) | COc1ccc(cc1)c2cc(c3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6ccc(cc6F)F | |
| AKOS005254204 | 556.539 | C29 H18 F2 N4 O4 S | XWRNQCUPVXMLBM-UHFFFAOYSA-N | InChI=1S/C29H18F2N4O4S/c1-38-18-10-8-17(9-11-18)35-25(29(37)39-34-35)26(36)27-24(32)23-20(19-12-7-16(30)13-21(19)31)14-22(33-28(23)40-27)15-5-3-2-4-6-15/h2-14H,1H3,(H2-,32,34,36,37) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5ccccc5)c6ccc(cc6F)F)N | |
| AKOS005253697 | 539.004 | C29 H19 Cl N4 O3 S | FTMIGLFXIDJFFJ-UHFFFAOYSA-N | InChI=1S/C29H19ClN4O3S/c1-16-7-9-17(10-8-16)21-15-22(18-11-13-19(30)14-12-18)32-28-23(21)24(31)27(38-28)26(35)25-29(36)37-33-34(25)20-5-3-2-4-6-20/h2-15H,1H3,(H2-,31,33,35,36) | Cc1ccc(cc1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6ccc(cc6)Cl | |
| AKOS005253765 | 538.549 | C29 H19 F N4 O4 S | BOKTXZYHWATGEC-UHFFFAOYSA-N | InChI=1S/C29H19FN4O4S/c1-37-20-12-10-16(11-13-20)22-15-21(17-6-5-7-18(30)14-17)23-24(31)27(39-28(23)32-22)26(35)25-29(36)38-33-34(25)19-8-3-2-4-9-19/h2-15H,1H3,(H2-,31,33,35,36) | COc1ccc(cc1)c2cc(c3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6cccc(c6)F | |
| AKOS005254199 | 538.549 | C29 H19 F N4 O4 S | FWQVCGBANJFFRN-UHFFFAOYSA-N | InChI=1S/C29H19FN4O4S/c1-37-20-12-10-19(11-13-20)34-25(29(36)38-33-34)26(35)27-24(31)23-21(17-8-5-9-18(30)14-17)15-22(32-28(23)39-27)16-6-3-2-4-7-16/h2-15H,1H3,(H2-,31,33,35,36) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5ccccc5)c6cccc(c6)F)N | |
| AKOS005250806 | 504.559 | C29 H20 N4 O3 S | RYWNEEKZOWDRPD-UHFFFAOYSA-N | InChI=1S/C29H20N4O3S/c1-19-12-14-20(15-13-19)23-16-25(21-8-4-2-5-9-21)31-28(24(23)17-30)37-18-26(34)27-29(35)36-32-33(27)22-10-6-3-7-11-22/h2-16H,18H2,1H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005253675 | 504.559 | C29 H20 N4 O3 S | ZVFQVVMMUHECHL-UHFFFAOYSA-N | InChI=1S/C29H20N4O3S/c1-17-12-14-18(15-13-17)21-16-22(19-8-4-2-5-9-19)31-28-23(21)24(30)27(37-28)26(34)25-29(35)36-32-33(25)20-10-6-3-7-11-20/h2-16H,1H3,(H2-,30,32,34,35) | Cc1ccc(cc1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6ccccc6 | |
| AKOS005250421 | 520.558 | C29 H20 N4 O4 S | JBFGGLBWCXMSHA-UHFFFAOYSA-N | InChI=1S/C29H20N4O4S/c1-36-22-14-12-21(13-15-22)33-27(29(35)37-32-33)26(34)18-38-28-24(17-30)23(19-8-4-2-5-9-19)16-25(31-28)20-10-6-3-7-11-20/h2-16H,18H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(c(cc(n3)c4ccccc4)c5ccccc5)C#N | |
| AKOS005250818 | 520.558 | C29 H20 N4 O4 S | FYGKDUXVWDEZMF-UHFFFAOYSA-N | InChI=1S/C29H20N4O4S/c1-36-22-14-12-19(13-15-22)23-16-25(20-8-4-2-5-9-20)31-28(24(23)17-30)38-18-26(34)27-29(35)37-32-33(27)21-10-6-3-7-11-21/h2-16H,18H2,1H3 | COc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005253724 | 520.558 | C29 H20 N4 O4 S | QWTJISLCZMYOKU-UHFFFAOYSA-N | InChI=1S/C29H20N4O4S/c1-36-20-14-12-18(13-15-20)22-16-21(17-8-4-2-5-9-17)23-24(30)27(38-28(23)31-22)26(34)25-29(35)37-32-33(25)19-10-6-3-7-11-19/h2-16H,1H3,(H2-,30,32,34,35) | COc1ccc(cc1)c2cc(c3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6ccccc6 | |
| AKOS005253730 | 520.558 | C29 H20 N4 O4 S | MAXOUGZXFGEHHY-UHFFFAOYSA-N | InChI=1S/C29H20N4O4S/c1-36-20-14-12-19(13-15-20)33-25(29(35)37-32-33)26(34)27-24(30)23-21(17-8-4-2-5-9-17)16-22(31-28(23)38-27)18-10-6-3-7-11-18/h2-16H,1H3,(H2-,30,32,34,35) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5ccccc5)c6ccccc6)N | |
| AKOS005253759 | 535.573 | C29 H21 N5 O4 S | ICGHNJFTQDIZNT-UHFFFAOYSA-N | InChI=1S/C29H21N5O4S/c1-37-20-9-5-6-17(14-20)21-15-22(16-10-12-18(30)13-11-16)32-28-23(21)24(31)27(39-28)26(35)25-29(36)38-33-34(25)19-7-3-2-4-8-19/h2-15H,1H3,(H4-,30,31,32,33,35,36) | COc1cccc(c1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6ccc(cc6)N | |
| AKOS005250453 | 538.574 | C29 H22 N4 O5 S | CPNIFZXNWBDHNL-AGPUXGRSSA-N | InChI=1S/C29H22N4O5S/c1-37-23-17-15-22(16-18-23)33-26(28(36)38-31-33)25(34)19-39-29-30-24(14-8-11-20-9-4-2-5-10-20)27(35)32(29)21-12-6-3-7-13-21/h2-18H,19H2,1H3/b11-8+,24-14+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/C=C/c4ccccc4)/C(=O)N3c5ccccc5 | |
| AKOS005253901 | 538.574 | C29 H22 N4 O5 S | MOYNQTGIXFTPHE-UHFFFAOYSA-N | InChI=1S/C29H22N4O5S/c1-33-25(29(35)38-32-33)26(34)27-24(30)23-20(19-12-11-16(36-2)13-22(19)37-3)14-21(31-28(23)39-27)18-10-6-8-15-7-4-5-9-17(15)18/h4-14H,1-3H3,(H2-,30,32,34,35) | C[n+]1c(c(on1)[O-])C(=O)c2c(c3c(cc(nc3s2)c4cccc5c4cccc5)c6ccc(cc6OC)OC)N | |
| AKOS005253942 | 624.59 | C29 H23 F3 N6 O5 S | NHJMBWPKPAKVKV-UHFFFAOYSA-N | InChI=1S/C29H23F3N6O5S/c1-36-23(26(43-35-36)34-25(40)18-8-4-2-5-9-18)17-37-22(27(41)38(28(37)44)20-10-6-3-7-11-20)16-24(39)33-19-12-14-21(15-13-19)42-29(30,31)32/h2-15,22H,16-17H2,1H3,(H-,33,34,35,39,40) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)OC(F)(F)F | |
| AKOS005251378 | 521.523 | C29 H23 N5 O5 | MGBYLHAWIXDLFT-UHFFFAOYSA-N | InChI=1S/C29H23N5O5/c35-26-16-23(32(19-14-15-19)17-24-29(37)39-31-34(24)21-6-2-1-3-7-21)28(36)33(26)20-12-10-18(11-13-20)27-30-22-8-4-5-9-25(22)38-27/h1-13,19,23H,14-17H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C4CC(=O)N(C4=O)c5ccc(cc5)c6nc7ccccc7o6 | |
| AKOS005250771 | 524.59 | C29 H24 N4 O4 S | XPEQLOSOPGNYGS-JJIBRWJFSA-N | InChI=1S/C29H24N4O4S/c1-19(2)21-15-13-20(14-16-21)17-24-27(35)32(22-9-5-3-6-10-22)29(30-24)38-18-25(34)26-28(36)37-31-33(26)23-11-7-4-8-12-23/h3-17,19H,18H2,1-2H3/b24-17+ | CC(C)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005250863 | 556.589 | C29 H24 N4 O6 S | BMVMJNVEVVIHAF-HAVVHWLPSA-N | InChI=1S/C29H24N4O6S/c1-3-38-25-12-8-7-9-19(25)17-23-27(35)32(20-10-5-4-6-11-20)29(30-23)40-18-24(34)26-28(36)39-31-33(26)21-13-15-22(37-2)16-14-21/h4-17H,3,18H2,1-2H3/b23-17+ | CCOc1ccccc1/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])c5ccccc5 | |
| AKOS005250869 | 556.589 | C29 H24 N4 O6 S | VIHBBPYTVKPFAT-JJIBRWJFSA-N | InChI=1S/C29H24N4O6S/c1-3-38-23-13-9-19(10-14-23)17-24-27(35)32(20-7-5-4-6-8-20)29(30-24)40-18-25(34)26-28(36)39-31-33(26)21-11-15-22(37-2)16-12-21/h4-17H,3,18H2,1-2H3/b24-17+ | CCOc1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])c5ccccc5 | |
| AKOS005250432 | 572.588 | C29 H24 N4 O7 S | LTJKFGXDYHDHGB-CJLVFECKSA-N | InChI=1S/C29H24N4O7S/c1-37-21-14-12-20(13-15-21)33-25(28(36)40-31-33)23(34)17-41-29-30-22(27(35)32(29)19-9-5-4-6-10-19)16-18-8-7-11-24(38-2)26(18)39-3/h4-16H,17H2,1-3H3/b22-16+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4cccc(c4OC)OC)/C(=O)N3c5ccccc5 | |
| AKOS005250439 | 572.588 | C29 H24 N4 O7 S | SEMMKDDSDVKMJF-PXLXIMEGSA-N | InChI=1S/C29H24N4O7S/c1-37-21-12-10-20(11-13-21)33-26(28(36)40-31-33)23(34)17-41-29-30-22(27(35)32(29)19-7-5-4-6-8-19)15-18-9-14-24(38-2)25(16-18)39-3/h4-16H,17H2,1-3H3/b22-15+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccc(c(c4)OC)OC)/C(=O)N3c5ccccc5 | |
| AKOS005250454 | 572.588 | C29 H24 N4 O7 S | CISWTPDEVGHKNO-HZHRSRAPSA-N | InChI=1S/C29H24N4O7S/c1-37-21-13-10-20(11-14-21)33-26(28(36)40-31-33)24(34)17-41-29-30-23(27(35)32(29)19-7-5-4-6-8-19)15-18-9-12-22(38-2)16-25(18)39-3/h4-16H,17H2,1-3H3/b23-15+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccc(cc4OC)OC)/C(=O)N3c5ccccc5 | |
| AKOS005250473 | 572.588 | C29 H24 N4 O7 S | VBOHSQVLHWDDJS-XQNSMLJCSA-N | InChI=1S/C29H24N4O7S/c1-37-21-11-9-20(10-12-21)33-26(28(36)40-31-33)24(34)17-41-29-30-23(27(35)32(29)19-7-5-4-6-8-19)16-18-15-22(38-2)13-14-25(18)39-3/h4-16H,17H2,1-3H3/b23-16+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4cc(ccc4OC)OC)/C(=O)N3c5ccccc5 | |
| AKOS005250762 | 572.588 | C29 H24 N4 O7 S | FHMBTFOHLXTGOB-KGENOOAVSA-N | InChI=1S/C29H24N4O7S/c1-37-23-16-25(39-3)24(38-2)15-18(23)14-21-27(35)32(19-10-6-4-7-11-19)29(30-21)41-17-22(34)26-28(36)40-31-33(26)20-12-8-5-9-13-20/h4-16H,17H2,1-3H3/b21-14+ | COc1cc(c(cc1OC)OC)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005250768 | 572.588 | C29 H24 N4 O7 S | OHNVFSACUJYMOB-KGENOOAVSA-N | InChI=1S/C29H24N4O7S/c1-37-23-15-18(16-24(38-2)26(23)39-3)14-21-27(35)32(19-10-6-4-7-11-19)29(30-21)41-17-22(34)25-28(36)40-31-33(25)20-12-8-5-9-13-20/h4-16H,17H2,1-3H3/b21-14+ | COc1cc(cc(c1OC)OC)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005253927 | 584.669 | C29 H24 N6 O4 S2 | LWCOVWSWKMRPLL-UHFFFAOYSA-N | InChI=1S/C29H24N6O4S2/c1-17-8-13-21-24(14-17)41-26(31-21)18-9-11-19(12-10-18)30-25(36)15-22-27(37)35(20-6-4-3-5-7-20)29(40)34(22)16-23-28(38)39-32-33(23)2/h3-14,22H,15-16H2,1-2H3,(H-,30,31,32,36,38) | Cc1ccc2c(c1)sc(n2)c3ccc(cc3)NC(=O)CC4C(=O)N(C(=S)N4Cc5c(on[n+]5C)[O-])c6ccccc6 | |
| AKOS005253832 | 568.603 | C29 H24 N6 O5 S | YTGSEHPMARZUKO-UHFFFAOYSA-N | InChI=1S/C29H24N6O5S/c1-17-7-13-20(14-8-17)35-27(37)22(34(29(35)41)16-23-28(38)40-32-33(23)2)15-25(36)30-19-11-9-18(10-12-19)26-31-21-5-3-4-6-24(21)39-26/h3-14,22H,15-16H2,1-2H3,(H-,30,31,32,36,38) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)c5nc6ccccc6o5 | |
| AKOS005253995 | 633.516 | C29 H25 Br N6 O4 S | TWSCEZDDAXIYEU-UHFFFAOYSA-N | InChI=1S/C29H25BrN6O4S/c1-18-8-14-22(15-9-18)36-28(39)23(16-25(37)31-21-12-10-20(30)11-13-21)35(29(36)41)17-24-27(40-33-34(24)2)32-26(38)19-6-4-3-5-7-19/h3-15,23H,16-17H2,1-2H3,(H-,31,32,33,37,38) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)Br | |
| AKOS005253992 | 589.065 | C29 H25 Cl N6 O4 S | OELMBXMCYBZVPW-UHFFFAOYSA-N | InChI=1S/C29H25ClN6O4S/c1-18-8-14-22(15-9-18)36-28(39)23(16-25(37)31-21-12-10-20(30)11-13-21)35(29(36)41)17-24-27(40-33-34(24)2)32-26(38)19-6-4-3-5-7-19/h3-15,23H,16-17H2,1-2H3,(H-,31,32,33,37,38) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)Cl | |
| AKOS005254009 | 572.61 | C29 H25 F N6 O4 S | PJIYCCQHLSFWOH-UHFFFAOYSA-N | InChI=1S/C29H25FN6O4S/c1-18-8-14-22(15-9-18)36-28(39)23(16-25(37)31-21-12-10-20(30)11-13-21)35(29(36)41)17-24-27(40-33-34(24)2)32-26(38)19-6-4-3-5-7-19/h3-15,23H,16-17H2,1-2H3,(H-,31,32,33,37,38) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)F | |
| AKOS005254139 | 674.671 | C29 H25 F3 N6 O6 S2 | XRFTTWMFVVVPLH-UHFFFAOYSA-N | InChI=1S/C29H25F3N6O6S2/c1-18-8-14-22(15-9-18)46(41,42)34-26-24(36(2)35-44-26)17-37-23(27(40)38(28(37)45)20-6-4-3-5-7-20)16-25(39)33-19-10-12-21(13-11-19)43-29(30,31)32/h3-15,23H,16-17H2,1-2H3,(H-,33,34,35,39) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)OC(F)(F)F | |
| AKOS005254005 | 680.516 | C29 H25 I N6 O4 S | HNQTXLZTNDCROG-UHFFFAOYSA-N | InChI=1S/C29H25IN6O4S/c1-18-8-14-22(15-9-18)36-28(39)23(16-25(37)31-21-12-10-20(30)11-13-21)35(29(36)41)17-24-27(40-33-34(24)2)32-26(38)19-6-4-3-5-7-19/h3-15,23H,16-17H2,1-2H3,(H-,31,32,33,37,38) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)I | |
| AKOS005252816 | 539.605 | C29 H25 N5 O4 S | DFIKMCXLTKLUID-KOEQRZSOSA-N | InChI=1S/C29H25N5O4S/c1-2-33-18-27(38-32-33)31-26(35)20-39-29-30-25(28(36)34(29)23-11-7-4-8-12-23)17-21-13-15-24(16-14-21)37-19-22-9-5-3-6-10-22/h3-18H,2,19-20H2,1H3/b25-17+ | CC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)OCc4ccccc4)/C(=O)N2c5ccccc5 | |
| AKOS005253919 | 539.605 | C29 H25 N5 O4 S | RVEUANPZXYWKAK-OUKQBFOZSA-N | InChI=1S/C29H25N5O4S/c1-32-25(28(37)38-31-32)19-33-24(27(36)34(29(33)39)23-10-6-3-7-11-23)18-26(35)30-22-16-14-21(15-17-22)13-12-20-8-4-2-5-9-20/h2-17,24H,18-19H2,1H3,(H-,30,31,35,37)/b13-12+ | C[n+]1c(c(on1)[O-])CN2C(C(=O)N(C2=S)c3ccccc3)CC(=O)Nc4ccc(cc4)/C=C/c5ccccc5 | |
| AKOS005250970 | 523.539 | C29 H25 N5 O5 | DTKCGTFLCGEMOD-UHFFFAOYSA-O | InChI=1S/C29H24N5O5/c35-26-13-7-12-24-21-14-19(17-33(24)26)16-32(18-21)28(37)23(30-27(36)20-8-3-1-4-9-20)15-25-29(38)39-31-34(25)22-10-5-2-6-11-22/h1-13,15,19,21H,14,16-18H2/q-1/p+1 | c1ccc(cc1)C(=O)N/C(=C\c2c(on[n+]2c3ccccc3)[O-])/C(=O)N4CC5CC(C4)c6cccc(=O)n6C5 | |
| AKOS005251094 | 523.539 | C29 H25 N5 O5 | XJMMQNZRHUBKRG-UHFFFAOYSA-O | InChI=1S/C29H24N5O5/c1-38-22-13-11-21(12-14-22)34-26(29(37)39-33-34)17-25(32-27(35)19-7-3-2-4-8-19)28(36)30-16-15-20-18-31-24-10-6-5-9-23(20)24/h2-14,17-18,31H,15-16H2,1H3,(H,30,36)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCCc3c[nH]c4c3cccc4)\NC(=O)c5ccccc5 | |
| AKOS005250460 | 555.604 | C29 H25 N5 O5 S | RLZNIYLHBSPGDF-JJIBRWJFSA-N | InChI=1S/C29H25N5O5S/c1-32(2)20-11-9-19(10-12-20)17-24-27(36)33(21-7-5-4-6-8-21)29(30-24)40-18-25(35)26-28(37)39-31-34(26)22-13-15-23(38-3)16-14-22/h4-17H,18H2,1-3H3/b24-17+ | CN(C)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])c5ccccc5 | |
| AKOS005253641 | 555.604 | C29 H25 N5 O5 S | MJMNTNXHQBHXFI-UHFFFAOYSA-N | InChI=1S/C29H25N5O5S/c1-18-7-12-22-25(15-18)40-27(31-22)19-8-10-20(11-9-19)30-26(35)16-24-28(36)33(13-14-38-24)17-23-29(37)39-32-34(23)21-5-3-2-4-6-21/h2-12,15,24H,13-14,16-17H2,1H3,(H-,30,31,32,35,37) | Cc1ccc2c(c1)sc(n2)c3ccc(cc3)NC(=O)CC4C(=O)N(CCO4)Cc5c(on[n+]5c6ccccc6)[O-] | |
| AKOS005253639 | 555.538 | C29 H25 N5 O7 | QHLWECZUHKRPNP-UHFFFAOYSA-N | InChI=1S/C29H25N5O7/c1-38-21-12-10-20(11-13-21)34-23(29(37)41-32-34)17-33-14-15-39-25(28(33)36)16-26(35)30-19-8-6-18(7-9-19)27-31-22-4-2-3-5-24(22)40-27/h2-13,25H,14-17H2,1H3,(H-,30,31,32,35,37) | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)c5nc6ccccc6o5 | |
| AKOS005253945 | 583.618 | C29 H25 N7 O5 S | LAOLSYFOMXNLJC-UHFFFAOYSA-N | InChI=1S/C29H25N7O5S/c1-34-23(27(41-33-34)32-26(39)19-8-4-2-5-9-19)17-35-22(28(40)36(29(35)42)21-10-6-3-7-11-21)16-24(37)31-20-14-12-18(13-15-20)25(30)38/h2-15,22H,16-17H2,1H3,(H3-,30,31,32,33,37,38,39) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)C(=O)N | |
| AKOS005253977 | 599.617 | C29 H25 N7 O6 S | GJRNGMPYHRAOGO-UHFFFAOYSA-N | InChI=1S/C29H25N7O6S/c1-18-8-12-21(13-9-18)35-28(39)23(16-25(37)30-20-10-14-22(15-11-20)36(40)41)34(29(35)43)17-24-27(42-32-33(24)2)31-26(38)19-6-4-3-5-7-19/h3-15,23H,16-17H2,1-2H3,(H-,30,31,32,37,38) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)N(=O)=O | |
| AKOS005250971 | 543.546 | C29 H26 F N5 O5 | ZOIDJZPVPOPINH-UHFFFAOYSA-O | InChI=1S/C29H25FN5O5/c1-39-22-13-11-21(12-14-22)35-26(29(38)40-32-35)19-24(31-27(36)20-7-3-2-4-8-20)28(37)34-17-15-33(16-18-34)25-10-6-5-9-23(25)30/h2-14,19H,15-18H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCN(CC3)c4ccccc4F)\NC(=O)c5ccccc5 | |
| AKOS005250979 | 543.546 | C29 H26 F N5 O5 | ASDCDMWFTRDTMI-UHFFFAOYSA-O | InChI=1S/C29H25FN5O5/c1-39-24-13-11-23(12-14-24)35-26(29(38)40-32-35)19-25(31-27(36)20-5-3-2-4-6-20)28(37)34-17-15-33(16-18-34)22-9-7-21(30)8-10-22/h2-14,19H,15-18H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCN(CC3)c4ccc(cc4)F)\NC(=O)c5ccccc5 | |
| AKOS005253627 | 510.541 | C29 H26 N4 O5 | WOQLNZASZHQMPV-VAWYXSNFSA-N | InChI=1S/C29H26N4O5/c34-27(30-23-15-13-22(14-16-23)12-11-21-7-3-1-4-8-21)19-26-28(35)32(17-18-37-26)20-25-29(36)38-31-33(25)24-9-5-2-6-10-24/h1-16,26H,17-20H2,(H-,30,31,34,36)/b12-11+ | c1ccc(cc1)/C=C/c2ccc(cc2)NC(=O)CC3C(=O)N(CCO3)Cc4c(on[n+]4c5ccccc5)[O-] | |
| AKOS005254192 | 590.604 | C29 H26 N4 O8 S | PPYPWZSKEBDMQK-UHFFFAOYSA-N | InChI=1S/C29H26N4O8S/c1-13-20(14(2)34)21(15-11-18(38-4)26(40-6)19(12-15)39-5)22-23(30)27(42-28(22)31-13)25(35)24-29(36)41-32-33(24)16-7-9-17(37-3)10-8-16/h7-12H,1-6H3,(H2-,30,32,35,36) | Cc1c(c(c2c(c(sc2n1)C(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])N)c5cc(c(c(c5)OC)OC)OC)C(=O)C | |
| AKOS005253134 | 538.62 | C29 H26 N6 O3 S | QOBAKFZHUZJCQI-XIEYBQDHSA-N | InChI=1S/C29H26N6O3S/c36-26(31-27-19-34(32-38-27)33-16-7-2-8-17-33)20-39-29-30-25(28(37)35(29)23-13-3-1-4-14-23)18-22-12-9-11-21-10-5-6-15-24(21)22/h1,3-6,9-15,18-19H,2,7-8,16-17,20H2/b25-18+ | c1ccc(cc1)N2C(=O)/C(=C\c3cccc4c3cccc4)/N=C2SCC(=O)[N-]c5c[n+](no5)N6CCCCC6 | |
| AKOS005252750 | 554.62 | C29 H26 N6 O4 S | HIOTUULNEZMCMM-KOEQRZSOSA-N | InChI=1S/C29H26N6O4S/c1-33(2)34-18-27(39-32-34)31-26(36)20-40-29-30-25(28(37)35(29)23-11-7-4-8-12-23)17-21-13-15-24(16-14-21)38-19-22-9-5-3-6-10-22/h3-18H,19-20H2,1-2H3/b25-17+ | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)OCc4ccccc4)/C(=O)N2c5ccccc5 | |
| AKOS005253940 | 554.62 | C29 H26 N6 O4 S | SEWZYZIMJRXVIM-UHFFFAOYSA-N | InChI=1S/C29H26N6O4S/c1-19-13-15-21(16-14-19)30-25(36)17-23-28(38)35(22-11-7-4-8-12-22)29(40)34(23)18-24-27(39-32-33(24)2)31-26(37)20-9-5-3-6-10-20/h3-16,23H,17-18H2,1-2H3,(H-,30,31,32,36,37) | Cc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)c5ccccc5 | |
| AKOS005253969 | 554.62 | C29 H26 N6 O4 S | UYNJZRRRFINSDG-UHFFFAOYSA-N | InChI=1S/C29H26N6O4S/c1-19-13-15-22(16-14-19)35-28(38)23(17-25(36)30-21-11-7-4-8-12-21)34(29(35)40)18-24-27(39-32-33(24)2)31-26(37)20-9-5-3-6-10-20/h3-16,23H,17-18H2,1-2H3,(H-,30,31,32,36,37) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccccc5 | |
| AKOS005251275 | 538.554 | C29 H26 N6 O5 | MZOYCWVXOBDRQY-NVQSTNCTSA-N | InChI=1S/C29H26N6O5/c1-39-24-15-13-23(14-16-24)35-26(29(38)40-32-35)18-33(21-11-12-21)25-17-27(36)34(28(25)37)22-9-7-20(8-10-22)31-30-19-5-3-2-4-6-19/h2-10,13-16,21,25H,11-12,17-18H2,1H3/b31-30+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C4CC(=O)N(C4=O)c5ccc(cc5)/N=N/c6ccccc6 | |
| AKOS005253941 | 570.619 | C29 H26 N6 O5 S | VLKVWHRVYDVXMW-UHFFFAOYSA-N | InChI=1S/C29H26N6O5S/c1-33-24(27(40-32-33)31-26(37)19-9-5-3-6-10-19)18-34-23(17-25(36)30-20-13-15-22(39-2)16-14-20)28(38)35(29(34)41)21-11-7-4-8-12-21/h3-16,23H,17-18H2,1-2H3,(H-,30,31,32,36,37) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)OC | |
| AKOS005250876 | 570.553 | C29 H26 N6 O7 | CDWBEUJEWQMRFD-UHFFFAOYSA-O | InChI=1S/C29H25N6O7/c1-41-24-13-11-22(12-14-24)34-26(29(38)42-31-34)19-25(30-27(36)20-5-3-2-4-6-20)28(37)33-17-15-32(16-18-33)21-7-9-23(10-8-21)35(39)40/h2-14,19H,15-18H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCN(CC3)c4ccc(cc4)[N+](=O)[O-])\NC(=O)c5ccccc5 | |
| AKOS005253854 | 570.553 | C29 H26 N6 O7 | CDWBEUJEWQMRFD-UHFFFAOYSA-O | InChI=1S/C29H25N6O7/c1-41-24-13-11-22(12-14-24)34-26(29(38)42-31-34)19-25(30-27(36)20-5-3-2-4-6-20)28(37)33-17-15-32(16-18-33)21-7-9-23(10-8-21)35(39)40/h2-14,19H,15-18H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCN(CC3)c4ccc(cc4)N(=O)=O)\NC(=O)c5ccccc5 | |
| AKOS005254076 | 683.596 | C29 H27 Br N6 O5 S2 | JXCQZACCBLUPLU-UHFFFAOYSA-N | InChI=1S/C29H27BrN6O5S2/c1-18-4-12-22(13-5-18)36-28(38)24(16-26(37)31-21-10-8-20(30)9-11-21)35(29(36)42)17-25-27(41-33-34(25)3)32-43(39,40)23-14-6-19(2)7-15-23/h4-15,24H,16-17H2,1-3H3,(H-,31,32,33,37) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)Br | |
| AKOS005254075 | 639.145 | C29 H27 Cl N6 O5 S2 | MMDHOVCLLNBVSG-UHFFFAOYSA-N | InChI=1S/C29H27ClN6O5S2/c1-18-4-12-22(13-5-18)36-28(38)24(16-26(37)31-21-10-8-20(30)9-11-21)35(29(36)42)17-25-27(41-33-34(25)3)32-43(39,40)23-14-6-19(2)7-15-23/h4-15,24H,16-17H2,1-3H3,(H-,31,32,33,37) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)Cl | |
| AKOS005254078 | 622.69 | C29 H27 F N6 O5 S2 | FSDXDJCSPKJFEF-UHFFFAOYSA-N | InChI=1S/C29H27FN6O5S2/c1-18-4-12-22(13-5-18)36-28(38)24(16-26(37)31-21-10-8-20(30)9-11-21)35(29(36)42)17-25-27(41-33-34(25)3)32-43(39,40)23-14-6-19(2)7-15-23/h4-15,24H,16-17H2,1-3H3,(H-,31,32,33,37) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)F | |
| AKOS005254077 | 730.596 | C29 H27 I N6 O5 S2 | WLUVIHVPHQZYKU-UHFFFAOYSA-N | InChI=1S/C29H27IN6O5S2/c1-18-4-12-22(13-5-18)36-28(38)24(16-26(37)31-21-10-8-20(30)9-11-21)35(29(36)42)17-25-27(41-33-34(25)3)32-43(39,40)23-14-6-19(2)7-15-23/h4-15,24H,16-17H2,1-3H3,(H-,31,32,33,37) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)I | |
| AKOS005251035 | 509.556 | C29 H27 N5 O4 | PUJKADXQWVKOBJ-UHFFFAOYSA-O | InChI=1S/C29H26N5O4/c1-21-12-14-23(15-13-21)32-16-18-33(19-17-32)28(36)25(30-27(35)22-8-4-2-5-9-22)20-26-29(37)38-31-34(26)24-10-6-3-7-11-24/h2-15,20H,16-19H2,1H3/q-1/p+1 | Cc1ccc(cc1)N2CCN(CC2)C(=O)/C(=C/c3c(on[n+]3c4ccccc4)[O-])/NC(=O)c5ccccc5 | |
| AKOS005251050 | 509.556 | C29 H27 N5 O4 | ROFDBGPRLBCWEB-UHFFFAOYSA-O | InChI=1S/C29H26N5O4/c35-27(23-12-6-2-7-13-23)30-25(20-26-29(37)38-31-34(26)24-14-8-3-9-15-24)28(36)33-18-16-32(17-19-33)21-22-10-4-1-5-11-22/h1-15,20H,16-19,21H2/q-1/p+1 | c1ccc(cc1)CN2CCN(CC2)C(=O)/C(=C/c3c(on[n+]3c4ccccc4)[O-])/NC(=O)c5ccccc5 | |
| AKOS005250872 | 525.555 | C29 H27 N5 O5 | DZNWLRUDPHVLEK-UHFFFAOYSA-O | InChI=1S/C29H26N5O5/c1-38-24-14-12-23(13-15-24)34-26(29(37)39-31-34)20-25(30-27(35)21-8-4-2-5-9-21)28(36)33-18-16-32(17-19-33)22-10-6-3-7-11-22/h2-15,20H,16-19H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCN(CC3)c4ccccc4)\NC(=O)c5ccccc5 | |
| AKOS005254010 | 633.698 | C29 H27 N7 O6 S2 | IPDNLFQLQWBSDF-UHFFFAOYSA-N | InChI=1S/C29H27N7O6S2/c1-18-8-12-21(13-9-18)36-28(39)23(16-25(37)31-20-10-14-22(15-11-20)44(30,40)41)35(29(36)43)17-24-27(42-33-34(24)2)32-26(38)19-6-4-3-5-7-19/h3-15,23H,16-17H2,1-2H3,(H3-,30,31,32,33,37,38,40,41) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)S(=O)(=O)N | |
| AKOS005254142 | 633.698 | C29 H27 N7 O6 S2 | PXBBTPVXLHJFAJ-UHFFFAOYSA-N | InChI=1S/C29H27N7O6S2/c1-18-8-14-22(15-9-18)44(40,41)32-27-24(34(2)33-42-27)17-35-23(28(39)36(29(35)43)21-6-4-3-5-7-21)16-25(37)31-20-12-10-19(11-13-20)26(30)38/h3-15,23H,16-17H2,1-2H3,(H3-,30,31,32,33,37,38) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)C(=O)N | |
| AKOS005254066 | 649.697 | C29 H27 N7 O7 S2 | CLBMWHMQUJWWGN-UHFFFAOYSA-N | InChI=1S/C29H27N7O7S2/c1-18-4-10-21(11-5-18)35-28(38)24(16-26(37)30-20-8-12-22(13-9-20)36(39)40)34(29(35)44)17-25-27(43-32-33(25)3)31-45(41,42)23-14-6-19(2)7-15-23/h4-15,24H,16-17H2,1-3H3,(H-,30,31,32,37) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)N(=O)=O | |
| AKOS005251083 | 544.555 | C29 H28 N4 O7 | HJYNHADREHQIAM-UHFFFAOYSA-O | InChI=1S/C29H27N4O7/c1-37-22-12-10-21(11-13-22)33-24(29(36)40-32-33)18-23(31-27(34)20-7-5-4-6-8-20)28(35)30-16-15-19-9-14-25(38-2)26(17-19)39-3/h4-14,17-18H,15-16H2,1-3H3,(H,30,35)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NCCc3ccc(c(c3)OC)OC)\NC(=O)c4ccccc4 | |
| AKOS005253106 | 540.636 | C29 H28 N6 O3 S | XSTAAEJFUCOSCI-UHFFFAOYSA-N | InChI=1S/C29H28N6O3S/c1-20-6-8-21(9-7-20)24-16-26(22-10-12-23(37-2)13-11-22)31-29(25(24)17-30)39-19-27(36)32-28-18-35(33-38-28)34-14-4-3-5-15-34/h6-13,16,18H,3-5,14-15,19H2,1-2H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccc(cc5)OC | |
| AKOS005253096 | 556.635 | C29 H28 N6 O4 S | VBWPMSYMJMHQAT-UHFFFAOYSA-N | InChI=1S/C29H28N6O4S/c1-37-25-13-9-12-21(28(25)38-2)22-16-24(20-10-5-3-6-11-20)31-29(23(22)17-30)40-19-26(36)32-27-18-35(33-39-27)34-14-7-4-8-15-34/h3,5-6,9-13,16,18H,4,7-8,14-15,19H2,1-2H3 | COc1cccc(c1OC)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005253124 | 556.635 | C29 H28 N6 O4 S | PCKFSIHFBGJUQO-UHFFFAOYSA-N | InChI=1S/C29H28N6O4S/c1-37-21-11-12-26(38-2)23(15-21)22-16-25(20-9-5-3-6-10-20)31-29(24(22)17-30)40-19-27(36)32-28-18-35(33-39-28)34-13-7-4-8-14-34/h3,5-6,9-12,15-16,18H,4,7-8,13-14,19H2,1-2H3 | COc1ccc(c(c1)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5)OC | |
| AKOS005254061 | 604.7 | C29 H28 N6 O5 S2 | VIBHWWOUTNNVBS-UHFFFAOYSA-N | InChI=1S/C29H28N6O5S2/c1-19-9-13-22(14-10-19)35-28(37)24(17-26(36)30-21-7-5-4-6-8-21)34(29(35)41)18-25-27(40-32-33(25)3)31-42(38,39)23-15-11-20(2)12-16-23/h4-16,24H,17-18H2,1-3H3,(H-,30,31,32,36) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccccc5 | |
| AKOS005254137 | 604.7 | C29 H28 N6 O5 S2 | DKFIIKNGQUTJSD-UHFFFAOYSA-N | InChI=1S/C29H28N6O5S2/c1-19-9-13-21(14-10-19)30-26(36)17-24-28(37)35(22-7-5-4-6-8-22)29(41)34(24)18-25-27(40-32-33(25)3)31-42(38,39)23-15-11-20(2)12-16-23/h4-16,24H,17-18H2,1-3H3,(H-,30,31,32,36) | Cc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)c5ccccc5 | |
| AKOS005253068 | 588.634 | C29 H28 N6 O6 S | AKHPFUASKNAVGH-UHFFFAOYSA-N | InChI=1S/C29H28N6O6S/c1-37-24-13-20(14-25(38-2)28(24)39-3)21-15-23(19-7-5-4-6-8-19)31-29(22(21)16-30)42-18-26(36)32-27-17-35(33-41-27)34-9-11-40-12-10-34/h4-8,13-15,17H,9-12,18H2,1-3H3 | COc1cc(cc(c1OC)OC)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCOCC4)c5ccccc5 | |
| AKOS005254138 | 620.699 | C29 H28 N6 O6 S2 | LEJOYZLBCRXCJG-UHFFFAOYSA-N | InChI=1S/C29H28N6O6S2/c1-19-9-15-23(16-10-19)43(38,39)31-27-25(33(2)32-41-27)18-34-24(17-26(36)30-20-11-13-22(40-3)14-12-20)28(37)35(29(34)42)21-7-5-4-6-8-21/h4-16,24H,17-18H2,1-3H3,(H-,30,31,32,36) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)OC | |
| AKOS005251985 | 563.688 | C29 H29 N3 O5 S2 | PKTATJXRKLJNPD-UHFFFAOYSA-N | InChI=1S/C29H29N3O5S2/c1-3-22(39-27-29(35)37-31-32(27)20-13-9-6-10-14-20)25(33)30-26-24(28(34)36-4-2)21-16-15-19(17-23(21)38-26)18-11-7-5-8-12-18/h5-14,19,22H,3-4,15-17H2,1-2H3,(H-,30,31,33,34,35) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)c3ccccc3)C(=O)OCC)Sc4c(on[n+]4c5ccccc5)[O-] | |
| AKOS005251733 | 579.687 | C29 H29 N3 O6 S2 | RGKZWXAQPIBPMN-UHFFFAOYSA-N | InChI=1S/C29H29N3O6S2/c1-4-37-28(34)24-22-15-10-19(18-8-6-5-7-9-18)16-23(22)40-26(24)30-25(33)17(2)39-27-29(35)38-31-32(27)20-11-13-21(36-3)14-12-20/h5-9,11-14,17,19H,4,10,15-16H2,1-3H3,(H-,30,31,33,34,35) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccc(cc4)OC)[O-])CC(CC2)c5ccccc5 | |
| AKOS005252397 | 579.687 | C29 H29 N3 O6 S2 | OINJQXOHYWLPIV-UHFFFAOYSA-N | InChI=1S/C29H29N3O6S2/c1-4-22(40-27-29(35)38-31-32(27)19-11-13-20(36-2)14-12-19)25(33)30-26-24(28(34)37-3)21-15-10-18(16-23(21)39-26)17-8-6-5-7-9-17/h5-9,11-14,18,22H,4,10,15-16H2,1-3H3,(H-,30,31,33,34,35) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)c3ccccc3)C(=O)OC)Sc4c(on[n+]4c5ccc(cc5)OC)[O-] | |
| AKOS005252586 | 579.687 | C29 H29 N3 O6 S2 | GPMLMABIMJZADU-UHFFFAOYSA-N | InChI=1S/C29H29N3O6S2/c1-3-37-28(34)25-22-14-9-19(18-7-5-4-6-8-18)17-23(22)40-26(25)30-24(33)15-16-39-27-29(35)38-31-32(27)20-10-12-21(36-2)13-11-20/h4-8,10-13,19H,3,9,14-17H2,1-2H3,(H-,30,31,33,34,35) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])CC(CC2)c5ccccc5 | |
| AKOS005254079 | 683.778 | C29 H29 N7 O7 S3 | WSYDYGZXEPZLSD-UHFFFAOYSA-N | InChI=1S/C29H29N7O7S3/c1-18-4-10-21(11-5-18)36-28(38)24(16-26(37)31-20-8-14-22(15-9-20)45(30,39)40)35(29(36)44)17-25-27(43-33-34(25)3)32-46(41,42)23-12-6-19(2)7-13-23/h4-15,24H,16-17H2,1-3H3,(H3-,30,31,32,33,37,39,40) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)S(=O)(=O)N | |
| AKOS005251948 | 578.702 | C29 H30 N4 O5 S2 | KNYCVGNQTIWUMZ-UHFFFAOYSA-N | InChI=1S/C29H30N4O5S2/c1-3-22(40-27-29(36)38-31-33(27)20-13-9-6-10-14-20)25(34)30-26-24(28(35)37-4-2)21-15-16-32(18-23(21)39-26)17-19-11-7-5-8-12-19/h5-14,22H,3-4,15-18H2,1-2H3,(H-,30,31,34,35,36) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)Cc3ccccc3)C(=O)OCC)Sc4c(on[n+]4c5ccccc5)[O-] | |
| AKOS005251699 | 594.702 | C29 H30 N4 O6 S2 | PQPVMOMRFOYXNJ-UHFFFAOYSA-N | InChI=1S/C29H30N4O6S2/c1-4-38-28(35)24-22-14-15-32(16-19-8-6-5-7-9-19)17-23(22)41-26(24)30-25(34)18(2)40-27-29(36)39-31-33(27)20-10-12-21(37-3)13-11-20/h5-13,18H,4,14-17H2,1-3H3,(H-,30,31,34,35,36) | CCOC(=O)c1c2c(sc1NC(=O)C(C)Sc3c(on[n+]3c4ccc(cc4)OC)[O-])CN(CC2)Cc5ccccc5 | |
| AKOS005252402 | 594.702 | C29 H30 N4 O6 S2 | MAMYMWDLLIQHRW-UHFFFAOYSA-N | InChI=1S/C29H30N4O6S2/c1-4-22(41-27-29(36)39-31-33(27)19-10-12-20(37-2)13-11-19)25(34)30-26-24(28(35)38-3)21-14-15-32(17-23(21)40-26)16-18-8-6-5-7-9-18/h5-13,22H,4,14-17H2,1-3H3,(H-,30,31,34,35,36) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)Cc3ccccc3)C(=O)OC)Sc4c(on[n+]4c5ccc(cc5)OC)[O-] | |
| AKOS005252622 | 594.702 | C29 H30 N4 O6 S2 | OFJFLWHSYYIARJ-UHFFFAOYSA-N | InChI=1S/C29H30N4O6S2/c1-3-38-28(35)25-22-13-15-32(17-19-7-5-4-6-8-19)18-23(22)41-26(25)30-24(34)14-16-40-27-29(36)39-31-33(27)20-9-11-21(37-2)12-10-20/h4-12H,3,13-18H2,1-2H3,(H-,30,31,34,35,36) | CCOC(=O)c1c2c(sc1NC(=O)CCSc3c(on[n+]3c4ccc(cc4)OC)[O-])CN(CC2)Cc5ccccc5 | |
| AKOS005253103 | 559.682 | C29 H33 N7 O3 S | CMEOBYKMCOZOKR-NCELDCMTSA-N | InChI=1S/C29H33N7O3S/c1-3-33(4-2)23-15-13-22(14-16-23)19-25-28(38)36(24-11-7-5-8-12-24)29(30-25)40-21-26(37)31-27-20-35(32-39-27)34-17-9-6-10-18-34/h5,7-8,11-16,19-20H,3-4,6,9-10,17-18,21H2,1-2H3/b25-19+ | CCN(CC)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005219762 | 132.141 | C3 H4 N2 O2 S | BJNVTALTHTZKRL-UHFFFAOYSA-O | InChI=1S/C3H3N2O2S/c1-5-2(8)3(6)7-4-5/h1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])S | |
| AKOS005252565 | 99.091 | C3 H5 N3 O | MFZMQSNKFZJPHM-UHFFFAOYSA-N | InChI=1S/C3H5N3O/c1-6-2-3(4)7-5-6/h2,4H,1H3 | C[n+]1cc(on1)[NH-] | |
| AKOS005215719 | 135.552 | C3 H6 N3 O . Cl | IXRXQWQAFZCXJW-UHFFFAOYSA-M | InChI=1S/C3H6N3O.ClH/c1-6-2-3(4)7-5-6;/h2H,4H2,1H3;1H/q+1;/p-1 | C[n+]1cc(on1)N.[Cl-] | MFCD09881639 |
| AKOS005253752 | 623.002 | C30 H18 Cl F3 N4 O4 S | QWCDTTYPWDFVDJ-UHFFFAOYSA-N | InChI=1S/C30H18ClF3N4O4S/c1-41-20-12-10-19(11-13-20)38-25(29(40)42-37-38)26(39)27-24(35)23-21(15-2-6-17(7-3-15)30(32,33)34)14-22(36-28(23)43-27)16-4-8-18(31)9-5-16/h2-14H,1H3,(H2-,35,37,39,40) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5ccc(cc5)Cl)c6ccc(cc6)C(F)(F)F)N | |
| AKOS005253692 | 588.556 | C30 H19 F3 N4 O4 S | WLZNGMOOURYYOU-UHFFFAOYSA-N | InChI=1S/C30H19F3N4O4S/c1-40-20-13-11-19(12-14-20)37-25(29(39)41-36-37)26(38)27-24(34)23-21(16-7-9-18(10-8-16)30(31,32)33)15-22(35-28(23)42-27)17-5-3-2-4-6-17/h2-15H,1H3,(H2-,34,36,38,39) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5ccccc5)c6ccc(cc6)C(F)(F)F)N | |
| AKOS005253757 | 586.565 | C30 H20 F2 N4 O5 S | LIMVJQHVSBFSNM-UHFFFAOYSA-N | InChI=1S/C30H20F2N4O5S/c1-39-18-8-3-15(4-9-18)23-14-21(20-12-5-16(31)13-22(20)32)24-25(33)28(42-29(24)34-23)27(37)26-30(38)41-35-36(26)17-6-10-19(40-2)11-7-17/h3-14H,1-2H3,(H2-,33,35,37,38) | COc1ccc(cc1)c2cc(c3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N)c6ccc(cc6F)F | |
| AKOS005250667 | 532.569 | C30 H20 N4 O4 S | MKCLEDKAASCZRR-XIEYBQDHSA-N | InChI=1S/C30H20N4O4S/c35-26(27-29(37)38-32-34(27)23-15-5-2-6-16-23)19-39-30-31-25(28(36)33(30)22-13-3-1-4-14-22)18-21-12-9-11-20-10-7-8-17-24(20)21/h1-18H,19H2/b25-18+ | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4cccc5c4cccc5)/C(=O)N3c6ccccc6 | |
| AKOS005254179 | 569.03 | C30 H21 Cl N4 O4 S | NLDAZSAWVJBUNZ-UHFFFAOYSA-N | InChI=1S/C30H21ClN4O4S/c1-16-3-5-17(6-4-16)22-15-23(18-7-9-19(31)10-8-18)33-29-24(22)25(32)28(40-29)27(36)26-30(37)39-34-35(26)20-11-13-21(38-2)14-12-20/h3-15H,1-2H3,(H2-,32,34,36,37) | Cc1ccc(cc1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N)c6ccc(cc6)Cl | |
| AKOS005254182 | 568.575 | C30 H21 F N4 O5 S | WIOPDHJQXAZAKY-UHFFFAOYSA-N | InChI=1S/C30H21FN4O5S/c1-38-20-10-6-16(7-11-20)23-15-22(17-4-3-5-18(31)14-17)24-25(32)28(41-29(24)33-23)27(36)26-30(37)40-34-35(26)19-8-12-21(39-2)13-9-19/h3-15H,1-2H3,(H2-,32,34,36,37) | COc1ccc(cc1)c2cc(c3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N)c6cccc(c6)F | |
| AKOS005250429 | 534.585 | C30 H22 N4 O4 S | LFGOZSRIXOLCSH-UHFFFAOYSA-N | InChI=1S/C30H22N4O4S/c1-19-8-10-20(11-9-19)24-16-26(21-6-4-3-5-7-21)32-29(25(24)17-31)39-18-27(35)28-30(36)38-33-34(28)22-12-14-23(37-2)15-13-22/h3-16H,18H2,1-2H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])c5ccccc5 | |
| AKOS005250800 | 534.585 | C30 H22 N4 O4 S | ZJRNKGCBJJYLMA-UHFFFAOYSA-N | InChI=1S/C30H22N4O4S/c1-19-8-10-20(11-9-19)24-16-26(21-12-14-23(37-2)15-13-21)32-29(25(24)17-31)39-18-27(35)28-30(36)38-33-34(28)22-6-4-3-5-7-22/h3-16H,18H2,1-2H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccc(cc5)OC | |
| AKOS005253717 | 534.585 | C30 H22 N4 O4 S | JWWLZWAAUWCISA-UHFFFAOYSA-N | InChI=1S/C30H22N4O4S/c1-17-8-10-18(11-9-17)22-16-23(19-12-14-21(37-2)15-13-19)32-29-24(22)25(31)28(39-29)27(35)26-30(36)38-33-34(26)20-6-4-3-5-7-20/h3-16H,1-2H3,(H2-,31,33,35,36) | Cc1ccc(cc1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6ccc(cc6)OC | |
| AKOS005253767 | 534.585 | C30 H22 N4 O4 S | RXGWYBOQZZUYGT-UHFFFAOYSA-N | InChI=1S/C30H22N4O4S/c1-17-8-10-18(11-9-17)22-16-23(19-6-4-3-5-7-19)32-29-24(22)25(31)28(39-29)27(35)26-30(36)38-33-34(26)20-12-14-21(37-2)15-13-20/h3-16H,1-2H3,(H2-,31,33,35,36) | Cc1ccc(cc1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N)c6ccccc6 | |
| AKOS005250442 | 550.584 | C30 H22 N4 O5 S | YIXQGTJQLDMJQT-UHFFFAOYSA-N | InChI=1S/C30H22N4O5S/c1-37-22-12-8-19(9-13-22)24-16-26(20-6-4-3-5-7-20)32-29(25(24)17-31)40-18-27(35)28-30(36)39-33-34(28)21-10-14-23(38-2)15-11-21/h3-16H,18H2,1-2H3 | COc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])c5ccccc5 | |
| AKOS005250823 | 550.584 | C30 H22 N4 O5 S | SRRIXJFPMHXNEL-UHFFFAOYSA-N | InChI=1S/C30H22N4O5S/c1-37-21-13-14-27(38-2)23(15-21)22-16-25(19-9-5-3-6-10-19)32-29(24(22)17-31)40-18-26(35)28-30(36)39-33-34(28)20-11-7-4-8-12-20/h3-16H,18H2,1-2H3 | COc1ccc(c(c1)c2cc(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5)OC | |
| AKOS005250843 | 550.584 | C30 H22 N4 O5 S | DNNMWQYUCPSUED-UHFFFAOYSA-N | InChI=1S/C30H22N4O5S/c1-37-26-15-9-14-21(28(26)38-2)22-16-24(19-10-5-3-6-11-19)32-29(23(22)17-31)40-18-25(35)27-30(36)39-33-34(27)20-12-7-4-8-13-20/h3-16H,18H2,1-2H3 | COc1cccc(c1OC)c2cc(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005253712 | 550.584 | C30 H22 N4 O5 S | ZUSIJWMWVOHOSG-UHFFFAOYSA-N | InChI=1S/C30H22N4O5S/c1-37-22-15-9-14-19(27(22)38-2)20-16-21(17-10-5-3-6-11-17)32-29-23(20)24(31)28(40-29)26(35)25-30(36)39-33-34(25)18-12-7-4-8-13-18/h3-16H,1-2H3,(H2-,31,33,35,36) | COc1cccc(c1OC)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6ccccc6 | |
| AKOS005253737 | 550.584 | C30 H22 N4 O5 S | BTHITGSHOAJAJL-UHFFFAOYSA-N | InChI=1S/C30H22N4O5S/c1-37-22-14-13-18(15-23(22)38-2)20-16-21(17-9-5-3-6-10-17)32-29-24(20)25(31)28(40-29)27(35)26-30(36)39-33-34(26)19-11-7-4-8-12-19/h3-16H,1-2H3,(H2-,31,33,35,36) | COc1ccc(cc1OC)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6ccccc6 | |
| AKOS005253769 | 550.584 | C30 H22 N4 O5 S | XVCGVBFNSGOLIW-UHFFFAOYSA-N | InChI=1S/C30H22N4O5S/c1-37-20-12-8-18(9-13-20)23-16-22(17-6-4-3-5-7-17)24-25(31)28(40-29(24)32-23)27(35)26-30(36)39-33-34(26)19-10-14-21(38-2)15-11-19/h3-16H,1-2H3,(H2-,31,33,35,36) | COc1ccc(cc1)c2cc(c3c(c(sc3n2)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N)c6ccccc6 | |
| AKOS005253779 | 550.584 | C30 H22 N4 O5 S | NFENSXROLKPYSQ-UHFFFAOYSA-N | InChI=1S/C30H22N4O5S/c1-37-19-13-14-23(38-2)20(15-19)21-16-22(17-9-5-3-6-10-17)32-29-24(21)25(31)28(40-29)27(35)26-30(36)39-33-34(26)18-11-7-4-8-12-18/h3-16H,1-2H3,(H2-,31,33,35,36) | COc1ccc(c(c1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6ccccc6)OC | |
| AKOS005253758 | 565.599 | C30 H23 N5 O5 S | COWGCYBVACXZAC-UHFFFAOYSA-N | InChI=1S/C30H23N5O5S/c1-38-20-12-10-19(11-13-20)35-26(30(37)40-34-35)27(36)28-25(32)24-22(17-4-3-5-21(14-17)39-2)15-23(33-29(24)41-28)16-6-8-18(31)9-7-16/h3-15H,1-2H3,(H4-,31,32,33,34,36,37) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5ccc(cc5)N)c6cccc(c6)OC)N | |
| AKOS005253975 | 638.617 | C30 H25 F3 N6 O5 S | ADHWTWXTKYORTD-UHFFFAOYSA-N | InChI=1S/C30H25F3N6O5S/c1-18-8-12-21(13-9-18)39-28(42)23(16-25(40)34-20-10-14-22(15-11-20)43-30(31,32)33)38(29(39)45)17-24-27(44-36-37(24)2)35-26(41)19-6-4-3-5-7-19/h3-15,23H,16-17H2,1-2H3,(H-,34,35,36,40,41) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)OC(F)(F)F | |
| AKOS005250821 | 551.549 | C30 H25 N5 O6 | XMKLQJIEKAOTAM-UHFFFAOYSA-N | InChI=1S/C30H25N5O6/c1-39-22-14-12-21(13-15-22)35-25(30(38)41-32-35)17-33(19-10-11-19)24-16-27(36)34(29(24)37)20-8-6-18(7-9-20)28-31-23-4-2-3-5-26(23)40-28/h2-9,12-15,19,24H,10-11,16-17H2,1H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN(C3CC3)C4CC(=O)N(C4=O)c5ccc(cc5)c6nc7ccccc7o6 | |
| AKOS005254084 | 595.628 | C30 H25 N7 O5 S | QNUZCHXELLBAIW-UHFFFAOYSA-N | InChI=1S/C30H25N7O5S/c1-35-29(40)22(16-25(38)31-20-14-12-19(13-15-20)27-32-21-10-6-7-11-24(21)41-27)37(30(35)43)17-23-28(42-34-36(23)2)33-26(39)18-8-4-3-5-9-18/h3-15,22H,16-17H2,1-2H3,(H-,31,32,33,34,38,39) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)c5nc6ccccc6o5 | |
| AKOS005250864 | 554.616 | C30 H26 N4 O5 S | INYFCFMBVMNEIB-KOEQRZSOSA-N | InChI=1S/C30H26N4O5S/c1-19(2)21-11-9-20(10-12-21)17-25-28(36)33(22-7-5-4-6-8-22)30(31-25)40-18-26(35)27-29(37)39-32-34(27)23-13-15-24(38-3)16-14-23/h4-17,19H,18H2,1-3H3/b25-17+ | CC(C)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])c5ccccc5 | |
| AKOS005250860 | 602.614 | C30 H26 N4 O8 S | CYKHZEFMYNTYRJ-HYARGMPZSA-N | InChI=1S/C30H26N4O8S/c1-38-21-12-10-20(11-13-21)34-27(29(37)42-32-34)23(35)17-43-30-31-22(28(36)33(30)19-8-6-5-7-9-19)14-18-15-25(40-3)26(41-4)16-24(18)39-2/h5-16H,17H2,1-4H3/b22-14+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4cc(c(cc4OC)OC)OC)/C(=O)N3c5ccccc5 | |
| AKOS005250861 | 602.614 | C30 H26 N4 O8 S | ZHGQWMKFMAIKGQ-HYARGMPZSA-N | InChI=1S/C30H26N4O8S/c1-38-21-12-10-20(11-13-21)34-26(29(37)42-32-34)23(35)17-43-30-31-22(28(36)33(30)19-8-6-5-7-9-19)14-18-15-24(39-2)27(41-4)25(16-18)40-3/h5-16H,17H2,1-4H3/b22-14+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4cc(c(c(c4)OC)OC)OC)/C(=O)N3c5ccccc5 | |
| AKOS005253833 | 598.695 | C30 H26 N6 O4 S2 | YCOSCEIGONFSEC-UHFFFAOYSA-N | InChI=1S/C30H26N6O4S2/c1-17-4-11-21(12-5-17)36-28(38)23(35(30(36)41)16-24-29(39)40-33-34(24)3)15-26(37)31-20-9-7-19(8-10-20)27-32-22-13-6-18(2)14-25(22)42-27/h4-14,23H,15-16H2,1-3H3,(H-,31,32,33,37,39) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)c5nc6ccc(cc6s5)C | |
| AKOS005253946 | 582.63 | C30 H26 N6 O5 S | USKSQRMVQGLZLK-UHFFFAOYSA-N | InChI=1S/C30H26N6O5S/c1-19(37)20-13-15-22(16-14-20)31-26(38)17-24-29(40)36(23-11-7-4-8-12-23)30(42)35(24)18-25-28(41-33-34(25)2)32-27(39)21-9-5-3-6-10-21/h3-16,24H,17-18H2,1-2H3,(H-,31,32,33,37,38,39) | CC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)c5ccccc5 | |
| AKOS005253813 | 598.629 | C30 H26 N6 O6 S | RYULRRLNCYQBRE-UHFFFAOYSA-N | InChI=1S/C30H26N6O6S/c1-3-40-21-14-12-20(13-15-21)36-28(38)23(35(30(36)43)17-24-29(39)42-33-34(24)2)16-26(37)31-19-10-8-18(9-11-19)27-32-22-6-4-5-7-25(22)41-27/h4-15,23H,3,16-17H2,1-2H3,(H-,31,32,33,37,39) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)c5nc6ccccc6o5 | |
| AKOS005253947 | 598.629 | C30 H26 N6 O6 S | IOSNGCWTJRUUQT-UHFFFAOYSA-N | InChI=1S/C30H26N6O6S/c1-34-24(27(42-33-34)32-26(38)19-9-5-3-6-10-19)18-35-23(28(39)36(30(35)43)22-11-7-4-8-12-22)17-25(37)31-21-15-13-20(14-16-21)29(40)41-2/h3-16,23H,17-18H2,1-2H3,(H-,31,32,33,37,38,40) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)C(=O)OC | |
| AKOS005254030 | 663.542 | C30 H27 Br N6 O5 S | MXRHZYOTRRFQQG-UHFFFAOYSA-N | InChI=1S/C30H27BrN6O5S/c1-3-41-23-15-13-22(14-16-23)37-29(40)24(17-26(38)32-21-11-9-20(31)10-12-21)36(30(37)43)18-25-28(42-34-35(25)2)33-27(39)19-7-5-4-6-8-19/h4-16,24H,3,17-18H2,1-2H3,(H-,32,33,34,38,39) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)Br | |
| AKOS005254029 | 619.091 | C30 H27 Cl N6 O5 S | AGBCUQOZQHGWHL-UHFFFAOYSA-N | InChI=1S/C30H27ClN6O5S/c1-3-41-23-15-13-22(14-16-23)37-29(40)24(17-26(38)32-21-11-9-20(31)10-12-21)36(30(37)43)18-25-28(42-34-35(25)2)33-27(39)19-7-5-4-6-8-19/h4-16,24H,3,17-18H2,1-2H3,(H-,32,33,34,38,39) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)Cl | |
| AKOS005254032 | 602.636 | C30 H27 F N6 O5 S | IJIWWTZHIYHDPK-UHFFFAOYSA-N | InChI=1S/C30H27FN6O5S/c1-3-41-23-15-13-22(14-16-23)37-29(40)24(17-26(38)32-21-11-9-20(31)10-12-21)36(30(37)43)18-25-28(42-34-35(25)2)33-27(39)19-7-5-4-6-8-19/h4-16,24H,3,17-18H2,1-2H3,(H-,32,33,34,38,39) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)F | |
| AKOS005254064 | 688.697 | C30 H27 F3 N6 O6 S2 | GPWGFLKREURKCO-UHFFFAOYSA-N | InChI=1S/C30H27F3N6O6S2/c1-18-4-10-21(11-5-18)39-28(41)24(16-26(40)34-20-8-12-22(13-9-20)44-30(31,32)33)38(29(39)46)17-25-27(45-36-37(25)3)35-47(42,43)23-14-6-19(2)7-15-23/h4-15,24H,16-17H2,1-3H3,(H-,34,35,36,40) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)OC(F)(F)F | |
| AKOS005254031 | 710.542 | C30 H27 I N6 O5 S | ZSKGBPFCUHWBNV-UHFFFAOYSA-N | InChI=1S/C30H27IN6O5S/c1-3-41-23-15-13-22(14-16-23)37-29(40)24(17-26(38)32-21-11-9-20(31)10-12-21)36(30(37)43)18-25-28(42-34-35(25)2)33-27(39)19-7-5-4-6-8-19/h4-16,24H,3,17-18H2,1-2H3,(H-,32,33,34,38,39) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)I | |
| AKOS005251078 | 521.566 | C30 H27 N5 O4 | HFIFLVYJHLTKKH-WUKNDPDISA-O | InChI=1S/C30H26N5O4/c36-28(24-12-6-2-7-13-24)31-26(22-27-30(38)39-32-35(27)25-14-8-3-9-15-25)29(37)34-20-18-33(19-21-34)17-16-23-10-4-1-5-11-23/h1-17,22H,18-21H2/q-1/p+1/b17-16+ | c1ccc(cc1)/C=C/N2CCN(CC2)C(=O)/C(=C/c3c(on[n+]3c4ccccc4)[O-])/NC(=O)c5ccccc5 | |
| AKOS005250814 | 553.631 | C30 H27 N5 O4 S | BAHXBVXQYUNKEE-NCELDCMTSA-N | InChI=1S/C30H27N5O4S/c1-3-33(4-2)22-17-15-21(16-18-22)19-25-28(37)34(23-11-7-5-8-12-23)30(31-25)40-20-26(36)27-29(38)39-32-35(27)24-13-9-6-10-14-24/h5-19H,3-4,20H2,1-2H3/b25-19+ | CCN(CC)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005252776 | 553.631 | C30 H27 N5 O4 S | PZEHVCBLPIWWBS-YZSQISJMSA-N | InChI=1S/C30H27N5O4S/c1-21(2)34-18-28(39-33-34)32-27(36)20-40-30-31-26(29(37)35(30)24-11-7-4-8-12-24)17-22-13-15-25(16-14-22)38-19-23-9-5-3-6-10-23/h3-18,21H,19-20H2,1-2H3/b26-17+ | CC(C)[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)OCc4ccccc4)/C(=O)N2c5ccccc5 | |
| AKOS005253831 | 553.631 | C30 H27 N5 O4 S | OQFFHJXQRKSVGP-ZHACJKMWSA-N | InChI=1S/C30H27N5O4S/c1-20-8-16-24(17-9-20)35-28(37)25(34(30(35)40)19-26-29(38)39-32-33(26)2)18-27(36)31-23-14-12-22(13-15-23)11-10-21-6-4-3-5-7-21/h3-17,25H,18-19H2,1-2H3,(H-,31,32,36,38)/b11-10+ | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)/C=C/c5ccccc5 | |
| AKOS005251012 | 537.566 | C30 H27 N5 O5 | APYXKEGJIVQBAM-UHFFFAOYSA-O | InChI=1S/C30H26N5O5/c1-21(36)22-12-14-24(15-13-22)33-16-18-34(19-17-33)29(38)26(31-28(37)23-8-4-2-5-9-23)20-27-30(39)40-32-35(27)25-10-6-3-7-11-25/h2-15,20H,16-19H2,1H3/q-1/p+1 | CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)/C(=C/c3c(on[n+]3c4ccccc4)[O-])/NC(=O)c5ccccc5 | |
| AKOS005253352 | 569.631 | C30 H27 N5 O5 S | BJWCOXPODBXCGV-NLRVBDNBSA-N | InChI=1S/C30H27N5O5S/c1-38-17-16-34-19-28(40-33-34)32-27(36)21-41-30-31-26(29(37)35(30)24-10-6-3-7-11-24)18-22-12-14-25(15-13-22)39-20-23-8-4-2-5-9-23/h2-15,18-19H,16-17,20-21H2,1H3/b26-18+ | COCC[n+]1cc(on1)[N-]C(=O)CSC2=N/C(=C/c3ccc(cc3)OCc4ccccc4)/C(=O)N2c5ccccc5 | |
| AKOS005250916 | 553.565 | C30 H27 N5 O6 | JWBWWJFRMYJBPO-UHFFFAOYSA-O | InChI=1S/C30H26N5O6/c1-40-23-12-10-22(11-13-23)35-26(30(39)41-32-35)15-24(31-28(37)20-6-3-2-4-7-20)29(38)33-16-19-14-21(18-33)25-8-5-9-27(36)34(25)17-19/h2-13,15,19,21H,14,16-18H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CC4CC(C3)c5cccc(=O)n5C4)\NC(=O)c6ccccc6 | |
| AKOS005253640 | 585.63 | C30 H27 N5 O6 S | PIOWKHMXELWJJW-UHFFFAOYSA-N | InChI=1S/C30H27N5O6S/c1-18-3-12-23-26(15-18)42-28(32-23)19-4-6-20(7-5-19)31-27(36)16-25-29(37)34(13-14-40-25)17-24-30(38)41-33-35(24)21-8-10-22(39-2)11-9-21/h3-12,15,25H,13-14,16-17H2,1-2H3,(H-,31,32,33,36,38) | Cc1ccc2c(c1)sc(n2)c3ccc(cc3)NC(=O)CC4C(=O)N(CCO4)Cc5c(on[n+]5c6ccc(cc6)OC)[O-] | |
| AKOS005253949 | 597.644 | C30 H27 N7 O5 S | ASOYWNDQAOESFX-UHFFFAOYSA-N | InChI=1S/C30H27N7O5S/c1-19(38)31-21-13-15-22(16-14-21)32-26(39)17-24-29(41)37(23-11-7-4-8-12-23)30(43)36(24)18-25-28(42-34-35(25)2)33-27(40)20-9-5-3-6-10-20/h3-16,24,34H,17-18H2,1-2H3,(H,33,40) | CC(=O)Nc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)c5ccccc5 | |
| AKOS005253978 | 597.644 | C30 H27 N7 O5 S | PXTOUWMVEMSHFF-UHFFFAOYSA-N | InChI=1S/C30H27N7O5S/c1-18-8-14-22(15-9-18)37-29(41)23(16-25(38)32-21-12-10-19(11-13-21)26(31)39)36(30(37)43)17-24-28(42-34-35(24)2)33-27(40)20-6-4-3-5-7-20/h3-15,23H,16-17H2,1-2H3,(H3-,31,32,33,34,38,39,40) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)C(=O)N | |
| AKOS005254117 | 645.709 | C30 H27 N7 O6 S2 | AYDUGGPCHVDEDF-UHFFFAOYSA-N | InChI=1S/C30H27N7O6S2/c1-18-8-14-21(15-9-18)45(40,41)33-28-24(36(3)34-43-28)17-37-23(29(39)35(2)30(37)44)16-26(38)31-20-12-10-19(11-13-20)27-32-22-6-4-5-7-25(22)42-27/h4-15,23H,16-17H2,1-3H3,(H-,31,32,33,34,38) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)c5nc6ccccc6o5 | |
| AKOS005254020 | 629.643 | C30 H27 N7 O7 S | BHGWEZMDZFJYPM-UHFFFAOYSA-N | InChI=1S/C30H27N7O7S/c1-3-43-23-15-13-21(14-16-23)36-29(40)24(17-26(38)31-20-9-11-22(12-10-20)37(41)42)35(30(36)45)18-25-28(44-33-34(25)2)32-27(39)19-7-5-4-6-8-19/h4-16,24H,3,17-18H2,1-2H3,(H-,31,32,33,38,39) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)N(=O)=O | |
| AKOS005251043 | 508.568 | C30 H28 N4 O4 | IKDROAIFKSCUJF-UHFFFAOYSA-O | InChI=1S/C30H27N4O4/c35-28(24-12-6-2-7-13-24)31-26(21-27-30(37)38-32-34(27)25-14-8-3-9-15-25)29(36)33-18-16-23(17-19-33)20-22-10-4-1-5-11-22/h1-15,21,23H,16-20H2/q-1/p+1 | c1ccc(cc1)CC2CCN(CC2)C(=O)/C(=C/c3c(on[n+]3c4ccccc4)[O-])/NC(=O)c5ccccc5 | |
| AKOS005253638 | 540.567 | C30 H28 N4 O6 | ARALSKQFEJARHX-BQYQJAHWSA-N | InChI=1S/C30H28N4O6/c1-38-25-15-13-24(14-16-25)34-26(30(37)40-32-34)20-33-17-18-39-27(29(33)36)19-28(35)31-23-11-9-22(10-12-23)8-7-21-5-3-2-4-6-21/h2-16,27H,17-20H2,1H3,(H-,31,32,35,37)/b8-7+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)/C=C/c5ccccc5 | |
| AKOS005253973 | 568.646 | C30 H28 N6 O4 S | VXADINBLRITFOL-UHFFFAOYSA-N | InChI=1S/C30H28N6O4S/c1-19-9-13-22(14-10-19)31-26(37)17-24-29(39)36(23-15-11-20(2)12-16-23)30(41)35(24)18-25-28(40-33-34(25)3)32-27(38)21-7-5-4-6-8-21/h4-16,24H,17-18H2,1-3H3,(H-,31,32,33,37,38) | Cc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)c5ccc(cc5)C | |
| AKOS005253943 | 584.646 | C30 H28 N6 O5 S | HCDSSQHKQCTFGK-UHFFFAOYSA-N | InChI=1S/C30H28N6O5S/c1-3-40-23-16-14-21(15-17-23)31-26(37)18-24-29(39)36(22-12-8-5-9-13-22)30(42)35(24)19-25-28(41-33-34(25)2)32-27(38)20-10-6-4-7-11-20/h4-17,24H,3,18-19H2,1-2H3,(H-,31,32,33,37,38) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)c5ccccc5 | |
| AKOS005253974 | 584.646 | C30 H28 N6 O5 S | KEKCJTVLNWTBJR-UHFFFAOYSA-N | InChI=1S/C30H28N6O5S/c1-19-9-13-22(14-10-19)36-29(39)24(17-26(37)31-21-11-15-23(40-3)16-12-21)35(30(36)42)18-25-28(41-33-34(25)2)32-27(38)20-7-5-4-6-8-20/h4-16,24H,17-18H2,1-3H3,(H-,31,32,33,37,38) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)OC | |
| AKOS005254015 | 584.646 | C30 H28 N6 O5 S | HHAHZENCABKCSC-UHFFFAOYSA-N | InChI=1S/C30H28N6O5S/c1-3-40-23-16-14-22(15-17-23)36-29(39)24(18-26(37)31-21-12-8-5-9-13-21)35(30(36)42)19-25-28(41-33-34(25)2)32-27(38)20-10-6-4-7-11-20/h4-17,24H,3,18-19H2,1-2H3,(H-,31,32,33,37,38) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccccc5 | |
| AKOS005254143 | 632.71 | C30 H28 N6 O6 S2 | UODPYJZFAFYZGW-UHFFFAOYSA-N | InChI=1S/C30H28N6O6S2/c1-19-9-15-24(16-10-19)44(40,41)32-28-26(34(3)33-42-28)18-35-25(29(39)36(30(35)43)23-7-5-4-6-8-23)17-27(38)31-22-13-11-21(12-14-22)20(2)37/h4-16,25H,17-18H2,1-3H3,(H-,31,32,33,37,38) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)C(=O)C | |
| AKOS005254144 | 648.709 | C30 H28 N6 O7 S2 | XIWKSKSNCINZBY-UHFFFAOYSA-N | InChI=1S/C30H28N6O7S2/c1-19-9-15-23(16-10-19)45(40,41)32-27-25(34(2)33-43-27)18-35-24(28(38)36(30(35)44)22-7-5-4-6-8-22)17-26(37)31-21-13-11-20(12-14-21)29(39)42-3/h4-16,24H,17-18H2,1-3H3,(H-,31,32,33,37,39) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)C(=O)OC | |
| AKOS005254057 | 713.622 | C30 H29 Br N6 O6 S2 | ICIBIRBAXFCTLK-UHFFFAOYSA-N | InChI=1S/C30H29BrN6O6S2/c1-4-42-23-13-11-22(12-14-23)37-29(39)25(17-27(38)32-21-9-7-20(31)8-10-21)36(30(37)44)18-26-28(43-34-35(26)3)33-45(40,41)24-15-5-19(2)6-16-24/h5-16,25H,4,17-18H2,1-3H3,(H-,32,33,34,38) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)Br | |
| AKOS005254056 | 669.171 | C30 H29 Cl N6 O6 S2 | ZXRNVIRGDDOSGB-UHFFFAOYSA-N | InChI=1S/C30H29ClN6O6S2/c1-4-42-23-13-11-22(12-14-23)37-29(39)25(17-27(38)32-21-9-7-20(31)8-10-21)36(30(37)44)18-26-28(43-34-35(26)3)33-45(40,41)24-15-5-19(2)6-16-24/h5-16,25H,4,17-18H2,1-3H3,(H-,32,33,34,38) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)Cl | |
| AKOS005254059 | 652.716 | C30 H29 F N6 O6 S2 | CGCAUGGFUFMPCT-UHFFFAOYSA-N | InChI=1S/C30H29FN6O6S2/c1-4-42-23-13-11-22(12-14-23)37-29(39)25(17-27(38)32-21-9-7-20(31)8-10-21)36(30(37)44)18-26-28(43-34-35(26)3)33-45(40,41)24-15-5-19(2)6-16-24/h5-16,25H,4,17-18H2,1-3H3,(H-,32,33,34,38) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)F | |
| AKOS005254058 | 760.622 | C30 H29 I N6 O6 S2 | PGSMVIXSYRFEGT-UHFFFAOYSA-N | InChI=1S/C30H29IN6O6S2/c1-4-42-23-13-11-22(12-14-23)37-29(39)25(17-27(38)32-21-9-7-20(31)8-10-21)36(30(37)44)18-26-28(43-34-35(26)3)33-45(40,41)24-15-5-19(2)6-16-24/h5-16,25H,4,17-18H2,1-3H3,(H-,32,33,34,38) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)I | |
| AKOS005251046 | 523.582 | C30 H29 N5 O4 | VRKVGYMRKDDBMQ-UHFFFAOYSA-O | InChI=1S/C30H28N5O4/c36-28(23-12-6-2-7-13-23)32-26(20-27-30(38)39-33-35(27)25-14-8-3-9-15-25)29(37)31-24-16-18-34(19-17-24)21-22-10-4-1-5-11-22/h1-15,20,24H,16-19,21H2,(H,31,37)/q-1/p+1 | c1ccc(cc1)CN2CCC(CC2)NC(=O)/C(=C/c3c(on[n+]3c4ccccc4)[O-])/NC(=O)c5ccccc5 | |
| AKOS005251057 | 523.582 | C30 H29 N5 O4 | IMIGJIULIZKWNQ-UHFFFAOYSA-O | InChI=1S/C30H28N5O4/c1-21-13-14-22(2)26(19-21)33-15-17-34(18-16-33)29(37)25(31-28(36)23-9-5-3-6-10-23)20-27-30(38)39-32-35(27)24-11-7-4-8-12-24/h3-14,19-20H,15-18H2,1-2H3/q-1/p+1 | Cc1ccc(c(c1)N2CCN(CC2)C(=O)/C(=C/c3c(on[n+]3c4ccccc4)[O-])/NC(=O)c5ccccc5)C | |
| AKOS005250882 | 539.582 | C30 H29 N5 O5 | CMXWZTPJALXFQB-UHFFFAOYSA-O | InChI=1S/C30H28N5O5/c1-39-25-14-12-24(13-15-25)35-27(30(38)40-32-35)20-26(31-28(36)23-10-6-3-7-11-23)29(37)34-18-16-33(17-19-34)21-22-8-4-2-5-9-22/h2-15,20H,16-19,21H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCN(CC3)Cc4ccccc4)\NC(=O)c5ccccc5 | |
| AKOS005250980 | 539.582 | C30 H29 N5 O5 | WEWIENGTOSKBEU-UHFFFAOYSA-O | InChI=1S/C30H28N5O5/c1-21-8-10-23(11-9-21)33-16-18-34(19-17-33)29(37)26(31-28(36)22-6-4-3-5-7-22)20-27-30(38)40-32-35(27)24-12-14-25(39-2)15-13-24/h3-15,20H,16-19H2,1-2H3/q-1/p+1 | Cc1ccc(cc1)N2CCN(CC2)C(=O)/C(=C/c3c(on[n+]3c4ccc(cc4)OC)[O-])/NC(=O)c5ccccc5 | |
| AKOS005254067 | 647.725 | C30 H29 N7 O6 S2 | WSNFBRKYQHLVGO-UHFFFAOYSA-N | InChI=1S/C30H29N7O6S2/c1-18-4-12-22(13-5-18)37-29(40)24(16-26(38)32-21-10-8-20(9-11-21)27(31)39)36(30(37)44)17-25-28(43-34-35(25)3)33-45(41,42)23-14-6-19(2)7-15-23/h4-15,24H,16-17H2,1-3H3,(H3-,31,32,33,34,38,39) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)C(=O)N | |
| AKOS005254146 | 647.725 | C30 H29 N7 O6 S2 | ISKNRXBTLDESFX-UHFFFAOYSA-O | InChI=1S/C30H28N7O6S2/c1-19-9-15-24(16-10-19)45(41,42)33-28-26(35(3)34-43-28)18-36-25(29(40)37(30(36)44)23-7-5-4-6-8-23)17-27(39)32-22-13-11-21(12-14-22)31-20(2)38/h4-16,25,34H,17-18H2,1-3H3/q-1/p+1 | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)NC(=O)C | |
| AKOS005254033 | 663.724 | C30 H29 N7 O7 S2 | YDDYBAGCRPOWPN-UHFFFAOYSA-N | InChI=1S/C30H29N7O7S2/c1-3-43-22-13-11-21(12-14-22)37-29(40)24(17-26(38)32-20-9-15-23(16-10-20)46(31,41)42)36(30(37)45)18-25-28(44-34-35(25)2)33-27(39)19-7-5-4-6-8-19/h4-16,24H,3,17-18H2,1-2H3,(H3-,31,32,33,34,38,39,41,42) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)S(=O)(=O)N | |
| AKOS005254047 | 679.723 | C30 H29 N7 O8 S2 | RELSNHJYRWFODQ-UHFFFAOYSA-N | InChI=1S/C30H29N7O8S2/c1-4-44-23-13-11-21(12-14-23)36-29(39)25(17-27(38)31-20-7-9-22(10-8-20)37(40)41)35(30(36)46)18-26-28(45-33-34(26)3)32-47(42,43)24-15-5-19(2)6-16-24/h5-16,25H,4,17-18H2,1-3H3,(H-,31,32,33,38) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)N(=O)=O | |
| AKOS005253066 | 586.661 | C30 H30 N6 O5 S | LIRBOYUPUXYXGA-UHFFFAOYSA-N | InChI=1S/C30H30N6O5S/c1-38-25-14-21(15-26(39-2)29(25)40-3)22-16-24(20-10-6-4-7-11-20)32-30(23(22)17-31)42-19-27(37)33-28-18-36(34-41-28)35-12-8-5-9-13-35/h4,6-7,10-11,14-16,18H,5,8-9,12-13,19H2,1-3H3 | COc1cc(cc(c1OC)OC)c2cc(nc(c2C#N)SCC(=O)[N-]c3c[n+](no3)N4CCCCC4)c5ccccc5 | |
| AKOS005254062 | 618.726 | C30 H30 N6 O5 S2 | HRGRCTNFZCJWSC-UHFFFAOYSA-N | InChI=1S/C30H30N6O5S2/c1-19-5-11-22(12-6-19)31-27(37)17-25-29(38)36(23-13-7-20(2)8-14-23)30(42)35(25)18-26-28(41-33-34(26)4)32-43(39,40)24-15-9-21(3)10-16-24/h5-16,25H,17-18H2,1-4H3,(H-,31,32,33,37) | Cc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)c5ccc(cc5)C | |
| AKOS005254063 | 634.726 | C30 H30 N6 O6 S2 | HPFJSTBAQCONMY-UHFFFAOYSA-N | InChI=1S/C30H30N6O6S2/c1-19-5-11-22(12-6-19)36-29(38)25(17-27(37)31-21-9-13-23(41-4)14-10-21)35(30(36)43)18-26-28(42-33-34(26)3)32-44(39,40)24-15-7-20(2)8-16-24/h5-16,25H,17-18H2,1-4H3,(H-,31,32,33,37) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)OC | |
| AKOS005254140 | 634.726 | C30 H30 N6 O6 S2 | CYEDFVKBTTXSLV-UHFFFAOYSA-N | InChI=1S/C30H30N6O6S2/c1-4-41-23-14-12-21(13-15-23)31-27(37)18-25-29(38)36(22-8-6-5-7-9-22)30(43)35(25)19-26-28(42-33-34(26)3)32-44(39,40)24-16-10-20(2)11-17-24/h5-17,25H,4,18-19H2,1-3H3,(H-,31,32,33,37) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)c5ccccc5 | |
| AKOS005254194 | 634.726 | C30 H30 N6 O6 S2 | HMVUMYWJXNIONF-UHFFFAOYSA-N | InChI=1S/C30H30N6O6S2/c1-4-41-23-14-12-22(13-15-23)36-29(38)25(18-27(37)31-21-8-6-5-7-9-21)35(30(36)43)19-26-28(42-33-34(26)3)32-44(39,40)24-16-10-20(2)11-17-24/h5-17,25H,4,18-19H2,1-3H3,(H-,31,32,33,37) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccccc5 | |
| AKOS005252401 | 593.714 | C30 H31 N3 O6 S2 | GDFFSMFUELUHHE-UHFFFAOYSA-N | InChI=1S/C30H31N3O6S2/c1-4-23(41-28-30(36)39-32-33(28)20-12-14-21(37-3)15-13-20)26(34)31-27-25(29(35)38-5-2)22-16-11-19(17-24(22)40-27)18-9-7-6-8-10-18/h6-10,12-15,19,23H,4-5,11,16-17H2,1-3H3,(H-,31,32,34,35,36) | CCC(C(=O)Nc1c(c2c(s1)CC(CC2)c3ccccc3)C(=O)OCC)Sc4c(on[n+]4c5ccc(cc5)OC)[O-] | |
| AKOS005254060 | 713.804 | C30 H31 N7 O8 S3 | CCVYMBDJOJNKCO-UHFFFAOYSA-N | InChI=1S/C30H31N7O8S3/c1-4-44-22-11-9-21(10-12-22)37-29(39)25(17-27(38)32-20-7-15-23(16-8-20)47(31,40)41)36(30(37)46)18-26-28(45-34-35(26)3)33-48(42,43)24-13-5-19(2)6-14-24/h5-16,25H,4,17-18H2,1-3H3,(H3-,31,32,33,34,38,40,41) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)S(=O)(=O)N | |
| AKOS005250822 | 608.728 | C30 H32 N4 O6 S2 | ULJRNTVCHLYETD-UHFFFAOYSA-N | InChI=1S/C30H32N4O6S2/c1-4-23(42-28-30(37)40-32-34(28)20-11-13-21(38-3)14-12-20)26(35)31-27-25(29(36)39-5-2)22-15-16-33(18-24(22)41-27)17-19-9-7-6-8-10-19/h6-14,23H,4-5,15-18H2,1-3H3,(H-,31,32,35,36,37) | CCC(C(=O)Nc1c(c2c(s1)CN(CC2)Cc3ccccc3)C(=O)OCC)Sc4c(on[n+]4c5ccc(cc5)OC)[O-] | |
| AKOS005250865 | 562.595 | C31 H22 N4 O5 S | IIGHXVPRTFSTSF-NLRVBDNBSA-N | InChI=1S/C31H22N4O5S/c1-39-24-16-14-23(15-17-24)35-28(30(38)40-33-35)27(36)19-41-31-32-26(29(37)34(31)22-11-3-2-4-12-22)18-21-10-7-9-20-8-5-6-13-25(20)21/h2-18H,19H2,1H3/b26-18+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4cccc5c4cccc5)/C(=O)N3c6ccccc6 | |
| AKOS005250471 | 564.611 | C31 H24 N4 O5 S | ZMMFRXYCLQQJQV-UHFFFAOYSA-N | InChI=1S/C31H24N4O5S/c1-19-4-6-20(7-5-19)25-16-27(21-8-12-23(38-2)13-9-21)33-30(26(25)17-32)41-18-28(36)29-31(37)40-34-35(29)22-10-14-24(39-3)15-11-22/h4-16H,18H2,1-3H3 | Cc1ccc(cc1)c2cc(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])c5ccc(cc5)OC | |
| AKOS005253695 | 564.611 | C31 H24 N4 O5 S | FIGIHARUEBICOH-UHFFFAOYSA-N | InChI=1S/C31H24N4O5S/c1-17-4-6-18(7-5-17)23-16-24(19-8-12-21(38-2)13-9-19)33-30-25(23)26(32)29(41-30)28(36)27-31(37)40-34-35(27)20-10-14-22(39-3)15-11-20/h4-16H,1-3H3,(H2-,32,34,36,37) | Cc1ccc(cc1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N)c6ccc(cc6)OC | |
| AKOS005250423 | 580.61 | C31 H24 N4 O6 S | IXLNEDWKQFJYOZ-UHFFFAOYSA-N | InChI=1S/C31H24N4O6S/c1-38-21-11-9-20(10-12-21)35-29(31(37)41-34-35)27(36)18-42-30-25(17-32)23(16-26(33-30)19-7-5-4-6-8-19)24-15-22(39-2)13-14-28(24)40-3/h4-16H,18H2,1-3H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(c(cc(n3)c4ccccc4)c5cc(ccc5OC)OC)C#N | |
| AKOS005250464 | 580.61 | C31 H24 N4 O6 S | AVGAISDBXYAIGX-UHFFFAOYSA-N | InChI=1S/C31H24N4O6S/c1-38-21-14-12-20(13-15-21)35-28(31(37)41-34-35)26(36)18-42-30-24(17-32)23(16-25(33-30)19-8-5-4-6-9-19)22-10-7-11-27(39-2)29(22)40-3/h4-16H,18H2,1-3H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(c(cc(n3)c4ccccc4)c5cccc(c5OC)OC)C#N | |
| AKOS005250819 | 580.61 | C31 H24 N4 O6 S | WJMRISYRQUXMDG-UHFFFAOYSA-N | InChI=1S/C31H24N4O6S/c1-38-26-14-20(15-27(39-2)29(26)40-3)22-16-24(19-10-6-4-7-11-19)33-30(23(22)17-32)42-18-25(36)28-31(37)41-34-35(28)21-12-8-5-9-13-21/h4-16H,18H2,1-3H3 | COc1cc(cc(c1OC)OC)c2cc(nc(c2C#N)SCC(=O)c3c(on[n+]3c4ccccc4)[O-])c5ccccc5 | |
| AKOS005253690 | 580.61 | C31 H24 N4 O6 S | BVUJWYNJSVGYIM-UHFFFAOYSA-N | InChI=1S/C31H24N4O6S/c1-38-22-14-18(15-23(39-2)28(22)40-3)20-16-21(17-10-6-4-7-11-17)33-30-24(20)25(32)29(42-30)27(36)26-31(37)41-34-35(26)19-12-8-5-9-13-19/h4-16H,1-3H3,(H2-,32,34,36,37) | COc1cc(cc(c1OC)OC)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6ccccc6 | |
| AKOS005253731 | 580.61 | C31 H24 N4 O6 S | UYRKIJZCLCOLSV-UHFFFAOYSA-N | InChI=1S/C31H24N4O6S/c1-38-19-11-9-18(10-12-19)35-27(31(37)41-34-35)28(36)29-26(32)25-22(21-15-20(39-2)13-14-24(21)40-3)16-23(33-30(25)42-29)17-7-5-4-6-8-17/h4-16H,1-3H3,(H2-,32,34,36,37) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5ccccc5)c6cc(ccc6OC)OC)N | |
| AKOS005253732 | 580.61 | C31 H24 N4 O6 S | COEAZGVILKJHBO-UHFFFAOYSA-N | InChI=1S/C31H24N4O6S/c1-38-19-14-12-18(13-15-19)35-26(31(37)41-34-35)27(36)29-25(32)24-21(20-10-7-11-23(39-2)28(20)40-3)16-22(33-30(24)42-29)17-8-5-4-6-9-17/h4-16H,1-3H3,(H2-,32,34,36,37) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5ccccc5)c6cccc(c6OC)OC)N | |
| AKOS005253733 | 580.61 | C31 H24 N4 O6 S | ZKDYMCPLYGBEHY-UHFFFAOYSA-N | InChI=1S/C31H24N4O6S/c1-38-20-12-10-19(11-13-20)35-27(31(37)41-34-35)28(36)29-26(32)25-21(18-9-14-23(39-2)24(15-18)40-3)16-22(33-30(25)42-29)17-7-5-4-6-8-17/h4-16H,1-3H3,(H2-,32,34,36,37) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5ccccc5)c6ccc(c(c6)OC)OC)N | |
| AKOS005254018 | 668.643 | C31 H27 F3 N6 O6 S | IFESBSBJJJJEAG-UHFFFAOYSA-N | InChI=1S/C31H27F3N6O6S/c1-3-44-22-15-11-21(12-16-22)40-29(43)24(17-26(41)35-20-9-13-23(14-10-20)45-31(32,33)34)39(30(40)47)18-25-28(46-37-38(25)2)36-27(42)19-7-5-4-6-8-19/h4-16,24H,3,17-18H2,1-2H3,(H-,35,36,37,41,42) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)OC(F)(F)F | |
| AKOS005254085 | 625.721 | C31 H27 N7 O4 S2 | HGODGAWNABWZST-UHFFFAOYSA-N | InChI=1S/C31H27N7O4S2/c1-18-9-14-22-25(15-18)44-29(33-22)20-10-12-21(13-11-20)32-26(39)16-23-30(41)36(2)31(43)38(23)17-24-28(42-35-37(24)3)34-27(40)19-7-5-4-6-8-19/h4-15,23H,16-17H2,1-3H3,(H-,32,33,34,35,39,40) | Cc1ccc2c(c1)sc(n2)c3ccc(cc3)NC(=O)CC4C(=O)N(C(=S)N4Cc5c(on[n+]5C)[N-]C(=O)c6ccccc6)C | |
| AKOS005254001 | 609.655 | C31 H27 N7 O5 S | KAAWZZQRCMDCSI-UHFFFAOYSA-N | InChI=1S/C31H27N7O5S/c1-3-37-30(41)23(17-26(39)32-21-15-13-20(14-16-21)28-33-22-11-7-8-12-25(22)42-28)38(31(37)44)18-24-29(43-35-36(24)2)34-27(40)19-9-5-4-6-10-19/h4-16,23H,3,17-18H2,1-2H3,(H-,32,33,34,35,39,40) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)c5nc6ccccc6o5 | |
| AKOS005254083 | 580.657 | C31 H28 N6 O4 S | HDVGQDIYZJPIJI-BUHFOSPRSA-N | InChI=1S/C31H28N6O4S/c1-35-30(40)25(19-27(38)32-24-17-15-22(16-18-24)14-13-21-9-5-3-6-10-21)37(31(35)42)20-26-29(41-34-36(26)2)33-28(39)23-11-7-4-8-12-23/h3-18,25H,19-20H2,1-2H3,(H-,32,33,34,38,39)/b14-13+ | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)/C=C/c5ccccc5 | |
| AKOS005253069 | 596.656 | C31 H28 N6 O5 S | ZKUFFTPDLDHZDL-ZXVVBBHZSA-N | InChI=1S/C31H28N6O5S/c38-28(33-29-20-36(34-42-29)35-15-17-40-18-16-35)22-43-31-32-27(30(39)37(31)25-9-5-2-6-10-25)19-23-11-13-26(14-12-23)41-21-24-7-3-1-4-8-24/h1-14,19-20H,15-18,21-22H2/b27-19+ | c1ccc(cc1)COc2ccc(cc2)/C=C/3\C(=O)N(C(=N3)SCC(=O)[N-]c4c[n+](no4)N5CCOCC5)c6ccccc6 | |
| AKOS005253979 | 596.656 | C31 H28 N6 O5 S | NPWIDSOAJRNAFG-UHFFFAOYSA-N | InChI=1S/C31H28N6O5S/c1-19-9-15-24(16-10-19)37-30(41)25(17-27(39)32-23-13-11-21(12-14-23)20(2)38)36(31(37)43)18-26-29(42-34-35(26)3)33-28(40)22-7-5-4-6-8-22/h4-16,25H,17-18H2,1-3H3,(H-,32,33,34,38,39,40) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)C(=O)C | |
| AKOS005253814 | 628.721 | C31 H28 N6 O5 S2 | XMVYBIYMUGLQKC-UHFFFAOYSA-N | InChI=1S/C31H28N6O5S2/c1-4-41-22-12-10-21(11-13-22)37-29(39)24(36(31(37)43)17-25-30(40)42-34-35(25)3)16-27(38)32-20-8-6-19(7-9-20)28-33-23-14-5-18(2)15-26(23)44-28/h5-15,24H,4,16-17H2,1-3H3,(H-,32,33,34,38,40) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)c5nc6ccc(cc6s5)C | |
| AKOS005253948 | 612.656 | C31 H28 N6 O6 S | PICFMGBKUYPVIG-UHFFFAOYSA-N | InChI=1S/C31H28N6O6S/c1-3-42-30(41)21-14-16-22(17-15-21)32-26(38)18-24-29(40)37(23-12-8-5-9-13-23)31(44)36(24)19-25-28(43-34-35(25)2)33-27(39)20-10-6-4-7-11-20/h4-17,24H,3,18-19H2,1-2H3,(H-,32,33,34,38,39,41) | CCOC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)c5ccccc5 | |
| AKOS005253980 | 612.656 | C31 H28 N6 O6 S | DMJNQOWOMOMGIK-UHFFFAOYSA-N | InChI=1S/C31H28N6O6S/c1-19-9-15-23(16-10-19)37-29(40)24(17-26(38)32-22-13-11-21(12-14-22)30(41)42-3)36(31(37)44)18-25-28(43-34-35(25)2)33-27(39)20-7-5-4-6-8-20/h4-16,24H,17-18H2,1-3H3,(H-,32,33,34,38,39,41) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)C(=O)OC | |
| AKOS005254045 | 718.723 | C31 H29 F3 N6 O7 S2 | NUYFZMOEGIAVTI-UHFFFAOYSA-N | InChI=1S/C31H29F3N6O7S2/c1-4-45-22-13-9-21(10-14-22)40-29(42)25(17-27(41)35-20-7-11-23(12-8-20)46-31(32,33)34)39(30(40)48)18-26-28(47-37-38(26)3)36-49(43,44)24-15-5-19(2)6-16-24/h5-16,25H,4,17-18H2,1-3H3,(H-,35,36,37,41) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)OC(F)(F)F | |
| AKOS005250875 | 551.592 | C31 H29 N5 O5 | MITOBIUYCKNXRY-WUKNDPDISA-O | InChI=1S/C31H28N5O5/c1-40-26-14-12-25(13-15-26)36-28(31(39)41-33-36)22-27(32-29(37)24-10-6-3-7-11-24)30(38)35-20-18-34(19-21-35)17-16-23-8-4-2-5-9-23/h2-17,22H,18-21H2,1H3/q-1/p+1/b17-16+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCN(CC3)/C=C/c4ccccc4)\NC(=O)c5ccccc5 | |
| AKOS005250411 | 583.657 | C31 H29 N5 O5 S | ZGVJKZHBNMOXBC-LGUFXXKBSA-N | InChI=1S/C31H29N5O5S/c1-4-34(5-2)22-13-11-21(12-14-22)19-26-29(38)35(23-9-7-6-8-10-23)31(32-26)42-20-27(37)28-30(39)41-33-36(28)24-15-17-25(40-3)18-16-24/h6-19H,4-5,20H2,1-3H3/b26-19+ | CCN(CC)c1ccc(cc1)/C=C/2\C(=O)N(C(=N2)SCC(=O)c3c(on[n+]3c4ccc(cc4)OC)[O-])c5ccccc5 | |
| AKOS005253812 | 583.657 | C31 H29 N5 O5 S | DBBHPGMHAFUQCM-MDZDMXLPSA-N | InChI=1S/C31H29N5O5S/c1-3-40-25-17-15-24(16-18-25)36-29(38)26(35(31(36)42)20-27-30(39)41-33-34(27)2)19-28(37)32-23-13-11-22(12-14-23)10-9-21-7-5-4-6-8-21/h4-18,26H,3,19-20H2,1-2H3,(H-,32,33,37,39)/b10-9+ | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[O-])CC(=O)Nc4ccc(cc4)/C=C/c5ccccc5 | |
| AKOS005250973 | 567.592 | C31 H29 N5 O6 | KUACGQBCHOJKJC-UHFFFAOYSA-O | InChI=1S/C31H28N5O6/c1-21(37)22-8-10-24(11-9-22)34-16-18-35(19-17-34)30(39)27(32-29(38)23-6-4-3-5-7-23)20-28-31(40)42-33-36(28)25-12-14-26(41-2)15-13-25/h3-15,20H,16-19H2,1-2H3/q-1/p+1 | CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)/C(=C/c3c(on[n+]3c4ccc(cc4)OC)[O-])/NC(=O)c5ccccc5 | |
| AKOS005253982 | 611.671 | C31 H29 N7 O5 S | SHFQGRNQQRSUSF-UHFFFAOYSA-N | InChI=1S/C31H29N7O5S/c1-19-9-15-24(16-10-19)38-30(42)25(17-27(40)33-23-13-11-22(12-14-23)32-20(2)39)37(31(38)44)18-26-29(43-35-36(26)3)34-28(41)21-7-5-4-6-8-21/h4-16,25,35H,17-18H2,1-3H3,(H,34,41) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)NC(=O)C | |
| AKOS005254118 | 675.801 | C31 H29 N7 O5 S3 | QYRGCUYZJPJSLY-UHFFFAOYSA-N | InChI=1S/C31H29N7O5S3/c1-18-5-12-22(13-6-18)46(41,42)34-28-25(37(4)35-43-28)17-38-24(30(40)36(3)31(38)44)16-27(39)32-21-10-8-20(9-11-21)29-33-23-14-7-19(2)15-26(23)45-29/h5-15,24H,16-17H2,1-4H3,(H-,32,33,34,35,39) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)c5nc6ccc(cc6s5)C | |
| AKOS005254021 | 627.67 | C31 H29 N7 O6 S | BXNOLYHFLZXEQK-UHFFFAOYSA-N | InChI=1S/C31H29N7O6S/c1-3-43-23-15-13-22(14-16-23)38-30(42)24(17-26(39)33-21-11-9-19(10-12-21)27(32)40)37(31(38)45)18-25-29(44-35-36(25)2)34-28(41)20-7-5-4-6-8-20/h4-16,24H,3,17-18H2,1-2H3,(H3-,32,33,34,35,39,40,41) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)C(=O)N | |
| AKOS005254156 | 659.735 | C31 H29 N7 O6 S2 | LPBKUWCTMZOFHX-UHFFFAOYSA-N | InChI=1S/C31H29N7O6S2/c1-4-37-30(40)24(17-27(39)32-21-13-11-20(12-14-21)28-33-23-7-5-6-8-26(23)43-28)38(31(37)45)18-25-29(44-35-36(25)3)34-46(41,42)22-15-9-19(2)10-16-22/h5-16,24H,4,17-18H2,1-3H3,(H-,32,33,34,35,39) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)c5nc6ccccc6o5 | |
| AKOS005250880 | 538.594 | C31 H30 N4 O5 | SJVAGHZXOKEKAI-UHFFFAOYSA-O | InChI=1S/C31H29N4O5/c1-39-26-14-12-25(13-15-26)35-28(31(38)40-33-35)21-27(32-29(36)24-10-6-3-7-11-24)30(37)34-18-16-23(17-19-34)20-22-8-4-2-5-9-22/h2-15,21,23H,16-20H2,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)N3CCC(CC3)Cc4ccccc4)\NC(=O)c5ccccc5 | |
| AKOS005253976 | 598.672 | C31 H30 N6 O5 S | ITETVKYHLCIGCC-UHFFFAOYSA-N | InChI=1S/C31H30N6O5S/c1-4-41-24-16-12-22(13-17-24)32-27(38)18-25-30(40)37(23-14-10-20(2)11-15-23)31(43)36(25)19-26-29(42-34-35(26)3)33-28(39)21-8-6-5-7-9-21/h5-17,25H,4,18-19H2,1-3H3,(H-,32,33,34,38,39) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)c5ccc(cc5)C | |
| AKOS005254016 | 598.672 | C31 H30 N6 O5 S | ZHWKNOXRMIGBQJ-UHFFFAOYSA-N | InChI=1S/C31H30N6O5S/c1-4-41-24-16-14-23(15-17-24)37-30(40)25(18-27(38)32-22-12-10-20(2)11-13-22)36(31(37)43)19-26-29(42-34-35(26)3)33-28(39)21-8-6-5-7-9-21/h5-17,25H,4,18-19H2,1-3H3,(H-,32,33,34,38,39) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)C | |
| AKOS005254116 | 630.737 | C31 H30 N6 O5 S2 | PXDLNAOEGWZWNG-VAWYXSNFSA-N | InChI=1S/C31H30N6O5S2/c1-21-9-17-25(18-10-21)44(40,41)33-29-27(36(3)34-42-29)20-37-26(30(39)35(2)31(37)43)19-28(38)32-24-15-13-23(14-16-24)12-11-22-7-5-4-6-8-22/h4-18,26H,19-20H2,1-3H3,(H-,32,33,34,38)/b12-11+ | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C)CC(=O)Nc4ccc(cc4)/C=C/c5ccccc5 | |
| AKOS005254017 | 614.672 | C31 H30 N6 O6 S | XRCJNJQEOSRPGP-UHFFFAOYSA-N | InChI=1S/C31H30N6O6S/c1-4-42-24-16-12-22(13-17-24)37-30(40)25(18-27(38)32-21-10-14-23(41-3)15-11-21)36(31(37)44)19-26-29(43-34-35(26)2)33-28(39)20-8-6-5-7-9-20/h5-17,25H,4,18-19H2,1-3H3,(H-,32,33,34,38,39) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)OC | |
| AKOS005254068 | 646.736 | C31 H30 N6 O6 S2 | UFCHDCAFNGVCCJ-UHFFFAOYSA-N | InChI=1S/C31H30N6O6S2/c1-19-5-13-24(14-6-19)37-30(40)26(17-28(39)32-23-11-9-22(10-12-23)21(3)38)36(31(37)44)18-27-29(43-34-35(27)4)33-45(41,42)25-15-7-20(2)8-16-25/h5-16,26H,17-18H2,1-4H3,(H-,32,33,34,38,39) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)C(=O)C | |
| AKOS005254069 | 662.736 | C31 H30 N6 O7 S2 | FWFZMCVJIUDXEJ-UHFFFAOYSA-N | InChI=1S/C31H30N6O7S2/c1-19-5-13-23(14-6-19)37-29(39)25(17-27(38)32-22-11-9-21(10-12-22)30(40)43-4)36(31(37)45)18-26-28(44-34-35(26)3)33-46(41,42)24-15-7-20(2)8-16-24/h5-16,25H,17-18H2,1-4H3,(H-,32,33,34,38,40) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)C(=O)OC | |
| AKOS005254145 | 662.736 | C31 H30 N6 O7 S2 | COFRYPYZSYIEJU-UHFFFAOYSA-N | InChI=1S/C31H30N6O7S2/c1-4-43-30(40)21-12-14-22(15-13-21)32-27(38)18-25-29(39)37(23-8-6-5-7-9-23)31(45)36(25)19-26-28(44-34-35(26)3)33-46(41,42)24-16-10-20(2)11-17-24/h5-17,25H,4,18-19H2,1-3H3,(H-,32,33,34,38,40) | CCOC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)c5ccccc5 | |
| AKOS005250874 | 553.608 | C31 H31 N5 O5 | BDUHOTLTXBUBBA-UHFFFAOYSA-O | InChI=1S/C31H30N5O5/c1-21-9-10-22(2)27(19-21)34-15-17-35(18-16-34)30(38)26(32-29(37)23-7-5-4-6-8-23)20-28-31(39)41-33-36(28)24-11-13-25(40-3)14-12-24/h4-14,19-20H,15-18H2,1-3H3/q-1/p+1 | Cc1ccc(c(c1)N2CCN(CC2)C(=O)/C(=C/c3c(on[n+]3c4ccc(cc4)OC)[O-])/NC(=O)c5ccccc5)C | |
| AKOS005250997 | 553.608 | C31 H31 N5 O5 | ALRXZHUXBRZBTP-UHFFFAOYSA-O | InChI=1S/C31H30N5O5/c1-40-26-14-12-25(13-15-26)36-28(31(39)41-34-36)20-27(33-29(37)23-10-6-3-7-11-23)30(38)32-24-16-18-35(19-17-24)21-22-8-4-2-5-9-22/h2-15,20,24H,16-19,21H2,1H3,(H,32,38)/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])/C=C(/C(=O)NC3CCN(CC3)Cc4ccccc4)\NC(=O)c5ccccc5 | |
| AKOS005254071 | 661.751 | C31 H31 N7 O6 S2 | DZAIAZHAIKYFIK-UHFFFAOYSA-O | InChI=1S/C31H30N7O6S2/c1-19-5-13-24(14-6-19)38-30(41)26(17-28(40)33-23-11-9-22(10-12-23)32-21(3)39)37(31(38)45)18-27-29(44-35-36(27)4)34-46(42,43)25-15-7-20(2)8-16-25/h5-16,26,35H,17-18H2,1-4H3/q-1/p+1 | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)NC(=O)C | |
| AKOS005254048 | 677.751 | C31 H31 N7 O7 S2 | WPEPIGLLSQNSJL-UHFFFAOYSA-N | InChI=1S/C31H31N7O7S2/c1-4-44-23-13-11-22(12-14-23)38-30(41)25(17-27(39)33-21-9-7-20(8-10-21)28(32)40)37(31(38)46)18-26-29(45-35-36(26)3)34-47(42,43)24-15-5-19(2)6-16-24/h5-16,25H,4,17-18H2,1-3H3,(H3-,32,33,34,35,39,40) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)C(=O)N | |
| AKOS005254065 | 648.752 | C31 H32 N6 O6 S2 | FWYJGZGMRWNNDI-UHFFFAOYSA-N | InChI=1S/C31H32N6O6S2/c1-5-42-24-14-10-22(11-15-24)32-28(38)18-26-30(39)37(23-12-6-20(2)7-13-23)31(44)36(26)19-27-29(43-34-35(27)4)33-45(40,41)25-16-8-21(3)9-17-25/h6-17,26H,5,18-19H2,1-4H3,(H-,32,33,34,38) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)c5ccc(cc5)C | |
| AKOS005254195 | 648.752 | C31 H32 N6 O6 S2 | IMJPMCSDMZYZSU-UHFFFAOYSA-N | InChI=1S/C31H32N6O6S2/c1-5-42-24-14-12-23(13-15-24)37-30(39)26(18-28(38)32-22-10-6-20(2)7-11-22)36(31(37)44)19-27-29(43-34-35(27)4)33-45(40,41)25-16-8-21(3)9-17-25/h6-17,26H,5,18-19H2,1-4H3,(H-,32,33,34,38) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)C | |
| AKOS005254044 | 664.752 | C31 H32 N6 O7 S2 | YEFGXRCBINRGES-UHFFFAOYSA-N | InChI=1S/C31H32N6O7S2/c1-5-43-24-14-10-22(11-15-24)37-30(39)26(18-28(38)32-21-8-12-23(42-4)13-9-21)36(31(37)45)19-27-29(44-34-35(27)3)33-46(40,41)25-16-6-20(2)7-17-25/h6-17,26H,5,18-19H2,1-4H3,(H-,32,33,34,38) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)OC | |
| AKOS005252955 | 576.572 | C32 H18 F2 N4 O3 S | SJGMTBUYLOYXFH-UHFFFAOYSA-N | InChI=1S/C32H18F2N4O3S/c33-18-13-14-21(24(34)15-18)23-16-25(22-12-6-8-17-7-4-5-11-20(17)22)36-31-26(23)27(35)30(42-31)29(39)28-32(40)41-37-38(28)19-9-2-1-3-10-19/h1-16H,(H2-,35,37,39,40) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5cccc6c5cccc6)c7ccc(cc7F)F)N | |
| AKOS005253689 | 558.582 | C32 H19 F N4 O3 S | LIQIGUGRLAGPRO-UHFFFAOYSA-N | InChI=1S/C32H19FN4O3S/c33-20-11-6-10-19(16-20)24-17-25(23-15-7-9-18-8-4-5-14-22(18)23)35-31-26(24)27(34)30(41-31)29(38)28-32(39)40-36-37(28)21-12-2-1-3-13-21/h1-17H,(H2-,34,36,38,39) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5cccc6c5cccc6)c7cccc(c7)F)N | |
| AKOS005253711 | 540.591 | C32 H20 N4 O3 S | TUPYGPIKTGGKEZ-UHFFFAOYSA-N | InChI=1S/C32H20N4O3S/c33-27-26-24(20-10-3-1-4-11-20)18-25(23-17-9-13-19-12-7-8-16-22(19)23)34-31(26)40-30(27)29(37)28-32(38)39-35-36(28)21-14-5-2-6-15-21/h1-18H,(H2-,33,35,37,38) | c1ccc(cc1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6cccc7c6cccc7 | |
| AKOS005250443 | 610.636 | C32 H26 N4 O7 S | NPWOEPOBXIIQTC-UHFFFAOYSA-N | InChI=1S/C32H26N4O7S/c1-39-22-12-10-21(11-13-22)36-29(32(38)43-35-36)26(37)18-44-31-24(17-33)23(16-25(34-31)19-8-6-5-7-9-19)20-14-27(40-2)30(42-4)28(15-20)41-3/h5-16H,18H2,1-4H3 | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSc3c(c(cc(n3)c4ccccc4)c5cc(c(c(c5)OC)OC)OC)C#N | |
| AKOS005253756 | 610.636 | C32 H26 N4 O7 S | HGGBKUGCTCVKHV-UHFFFAOYSA-N | InChI=1S/C32H26N4O7S/c1-39-20-12-10-19(11-13-20)36-27(32(38)43-35-36)28(37)30-26(33)25-21(18-14-23(40-2)29(42-4)24(15-18)41-3)16-22(34-31(25)44-30)17-8-6-5-7-9-17/h5-16H,1-4H3,(H2-,33,35,37,38) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5ccccc5)c6cc(c(c(c6)OC)OC)OC)N | |
| AKOS005253967 | 621.666 | C32 H27 N7 O5 S | CHBQHFCCRKJBHC-UHFFFAOYSA-N | InChI=1S/C32H27N7O5S/c1-37-25(30(44-36-37)35-28(41)19-7-3-2-4-8-19)18-38-24(31(42)39(32(38)45)22-15-16-22)17-27(40)33-21-13-11-20(12-14-21)29-34-23-9-5-6-10-26(23)43-29/h2-14,22,24H,15-18H2,1H3,(H-,33,34,35,36,40,41) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)c6nc7ccccc7o6 | |
| AKOS005254002 | 639.747 | C32 H29 N7 O4 S2 | RYODDHXFVSNLPD-UHFFFAOYSA-N | InChI=1S/C32H29N7O4S2/c1-4-38-31(42)24(39(32(38)44)18-25-29(43-36-37(25)3)35-28(41)20-8-6-5-7-9-20)17-27(40)33-22-13-11-21(12-14-22)30-34-23-15-10-19(2)16-26(23)45-30/h5-16,24H,4,17-18H2,1-3H3,(H-,33,34,35,36,40,41) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)c5nc6ccc(cc6s5)C | |
| AKOS005254167 | 671.746 | C32 H29 N7 O6 S2 | WCIJVWWBDYHVKC-UHFFFAOYSA-N | InChI=1S/C32H29N7O6S2/c1-19-7-15-23(16-8-19)47(42,43)35-30-26(37(2)36-45-30)18-38-25(31(41)39(32(38)46)22-13-14-22)17-28(40)33-21-11-9-20(10-12-21)29-34-24-5-3-4-6-27(24)44-29/h3-12,15-16,22,25H,13-14,17-18H2,1-2H3,(H-,33,34,35,36,40) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)c6nc7ccccc7o6 | |
| AKOS005253067 | 594.683 | C32 H30 N6 O4 S | GVADKGFLPNRKNV-VFCFBJKWSA-N | InChI=1S/C32H30N6O4S/c39-29(34-30-21-37(35-42-30)36-18-8-3-9-19-36)23-43-32-33-28(31(40)38(32)26-12-6-2-7-13-26)20-24-14-16-27(17-15-24)41-22-25-10-4-1-5-11-25/h1-2,4-7,10-17,20-21H,3,8-9,18-19,22-23H2/b28-20+ | c1ccc(cc1)COc2ccc(cc2)/C=C/3\C(=O)N(C(=N3)SCC(=O)[N-]c4c[n+](no4)N5CCCCC5)c6ccccc6 | |
| AKOS005254000 | 594.683 | C32 H30 N6 O4 S | FVPYNQUTCKILGQ-CCEZHUSRSA-N | InChI=1S/C32H30N6O4S/c1-3-37-31(41)26(20-28(39)33-25-18-16-23(17-19-25)15-14-22-10-6-4-7-11-22)38(32(37)43)21-27-30(42-35-36(27)2)34-29(40)24-12-8-5-9-13-24/h4-19,26H,3,20-21H2,1-2H3,(H-,33,34,35,39,40)/b15-14+ | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]C(=O)c3ccccc3)CC(=O)Nc4ccc(cc4)/C=C/c5ccccc5 | |
| AKOS005253981 | 626.682 | C32 H30 N6 O6 S | YJVNTYHIWTVYLW-UHFFFAOYSA-N | InChI=1S/C32H30N6O6S/c1-4-43-31(42)22-12-14-23(15-13-22)33-27(39)18-25-30(41)38(24-16-10-20(2)11-17-24)32(45)37(25)19-26-29(44-35-36(26)3)34-28(40)21-8-6-5-7-9-21/h5-17,25H,4,18-19H2,1-3H3,(H-,33,34,35,39,40,42) | CCOC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)c5ccc(cc5)C | |
| AKOS005254022 | 626.682 | C32 H30 N6 O6 S | CBYPWJNAOUBGRQ-UHFFFAOYSA-N | InChI=1S/C32H30N6O6S/c1-4-43-25-16-14-24(15-17-25)38-31(42)26(18-28(40)33-23-12-10-21(11-13-23)20(2)39)37(32(38)45)19-27-30(44-35-36(27)3)34-29(41)22-8-6-5-7-9-22/h5-17,26H,4,18-19H2,1-3H3,(H-,33,34,35,39,40,41) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)C(=O)C | |
| AKOS005254023 | 642.682 | C32 H30 N6 O7 S | QGTCILLZJYTRAI-UHFFFAOYSA-N | InChI=1S/C32H30N6O7S/c1-4-44-24-16-14-23(15-17-24)38-30(41)25(18-27(39)33-22-12-10-21(11-13-22)31(42)43-3)37(32(38)46)19-26-29(45-35-36(26)2)34-28(40)20-8-6-5-7-9-20/h5-17,25H,4,18-19H2,1-3H3,(H-,33,34,35,39,40,42) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)C(=O)OC | |
| AKOS005254157 | 689.827 | C32 H31 N7 O5 S3 | VWVKLIFBODRVMY-UHFFFAOYSA-N | InChI=1S/C32H31N7O5S3/c1-5-38-31(41)25(17-28(40)33-22-11-9-21(10-12-22)30-34-24-15-8-20(3)16-27(24)46-30)39(32(38)45)18-26-29(44-36-37(26)4)35-47(42,43)23-13-6-19(2)7-14-23/h6-16,25H,5,17-18H2,1-4H3,(H-,33,34,35,36,40) | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)c5nc6ccc(cc6s5)C | |
| AKOS005254025 | 641.697 | C32 H31 N7 O6 S | FXDXIOVAZDPQRU-UHFFFAOYSA-N | InChI=1S/C32H31N7O6S/c1-4-44-25-16-14-24(15-17-25)39-31(43)26(18-28(41)34-23-12-10-22(11-13-23)33-20(2)40)38(32(39)46)19-27-30(45-36-37(27)3)35-29(42)21-8-6-5-7-9-21/h5-17,26,36H,4,18-19H2,1-3H3,(H,35,42) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)NC(=O)C | |
| AKOS005254189 | 644.764 | C32 H32 N6 O5 S2 | WIBVGBOEFHAOKK-OUKQBFOZSA-N | InChI=1S/C32H32N6O5S2/c1-4-37-31(40)27(20-29(39)33-25-16-14-24(15-17-25)13-12-23-8-6-5-7-9-23)38(32(37)44)21-28-30(43-35-36(28)3)34-45(41,42)26-18-10-22(2)11-19-26/h5-19,27H,4,20-21H2,1-3H3,(H-,33,34,35,39)/b13-12+ | CCN1C(=O)C(N(C1=S)Cc2c(on[n+]2C)[N-]S(=O)(=O)c3ccc(cc3)C)CC(=O)Nc4ccc(cc4)/C=C/c5ccccc5 | |
| AKOS005254019 | 628.698 | C32 H32 N6 O6 S | JCFOZROOUMFNER-UHFFFAOYSA-N | InChI=1S/C32H32N6O6S/c1-4-42-24-15-11-22(12-16-24)33-28(39)19-26-31(41)38(23-13-17-25(18-14-23)43-5-2)32(45)37(26)20-27-30(44-35-36(27)3)34-29(40)21-9-7-6-8-10-21/h6-18,26H,4-5,19-20H2,1-3H3,(H-,33,34,35,39,40) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)c5ccc(cc5)OCC | |
| AKOS005254100 | 644.697 | C32 H32 N6 O7 S | SBUIFNPUFVSAAA-UHFFFAOYSA-N | InChI=1S/C32H32N6O7S/c1-20(2)38-26(31(45-36-38)35-46(41,42)24-14-8-21(3)9-15-24)19-37-16-17-43-28(32(37)40)18-29(39)33-23-12-10-22(11-13-23)30-34-25-6-4-5-7-27(25)44-30/h4-15,20,28H,16-19H2,1-3H3,(H-,33,34,35,36,39) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)c5nc6ccccc6o5 | |
| AKOS005254049 | 676.762 | C32 H32 N6 O7 S2 | ZSEIWASETHKKQZ-UHFFFAOYSA-N | InChI=1S/C32H32N6O7S2/c1-5-44-25-14-12-24(13-15-25)38-31(41)27(18-29(40)33-23-10-8-22(9-11-23)21(3)39)37(32(38)46)19-28-30(45-35-36(28)4)34-47(42,43)26-16-6-20(2)7-17-26/h6-17,27H,5,18-19H2,1-4H3,(H-,33,34,35,39,40) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)C(=O)C | |
| AKOS005254070 | 676.762 | C32 H32 N6 O7 S2 | WJJVOLJKKBGBQK-UHFFFAOYSA-N | InChI=1S/C32H32N6O7S2/c1-5-44-31(41)22-10-12-23(13-11-22)33-28(39)18-26-30(40)38(24-14-6-20(2)7-15-24)32(46)37(26)19-27-29(45-35-36(27)4)34-47(42,43)25-16-8-21(3)9-17-25/h6-17,26H,5,18-19H2,1-4H3,(H-,33,34,35,39,41) | CCOC(=O)c1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)c5ccc(cc5)C | |
| AKOS005254050 | 692.762 | C32 H32 N6 O8 S2 | RTNQJRUTCYIMEE-UHFFFAOYSA-N | InChI=1S/C32H32N6O8S2/c1-5-45-24-14-12-23(13-15-24)38-30(40)26(18-28(39)33-22-10-8-21(9-11-22)31(41)44-4)37(32(38)47)19-27-29(46-35-36(27)3)34-48(42,43)25-16-6-20(2)7-17-25/h6-17,26H,5,18-19H2,1-4H3,(H-,33,34,35,39,41) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)C(=O)OC | |
| AKOS005254052 | 691.777 | C32 H33 N7 O7 S2 | KDNIGSRMCMIUDA-UHFFFAOYSA-O | InChI=1S/C32H32N7O7S2/c1-5-45-25-14-12-24(13-15-25)39-31(42)27(18-29(41)34-23-10-8-22(9-11-23)33-21(3)40)38(32(39)47)19-28-30(46-36-37(28)4)35-48(43,44)26-16-6-20(2)7-17-26/h6-17,27,36H,5,18-19H2,1-4H3/q-1/p+1 | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)NC(=O)C | |
| AKOS005254046 | 678.778 | C32 H34 N6 O7 S2 | RWTBXGDPRCODSQ-UHFFFAOYSA-N | InChI=1S/C32H34N6O7S2/c1-5-43-24-13-9-22(10-14-24)33-29(39)19-27-31(40)38(23-11-15-25(16-12-23)44-6-2)32(46)37(27)20-28-30(45-35-36(28)4)34-47(41,42)26-17-7-21(3)8-18-26/h7-18,27H,5-6,19-20H2,1-4H3,(H-,33,34,35,39) | CCOc1ccc(cc1)NC(=O)CC2C(=O)N(C(=S)N2Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)c5ccc(cc5)OCC | |
| AKOS005252954 | 608.589 | C33 H19 F3 N4 O3 S | OFNNFOVOPYCKRW-UHFFFAOYSA-N | InChI=1S/C33H19F3N4O3S/c34-33(35,36)20-15-13-19(14-16-20)24-17-25(23-12-6-8-18-7-4-5-11-22(18)23)38-31-26(24)27(37)30(44-31)29(41)28-32(42)43-39-40(28)21-9-2-1-3-10-21/h1-17H,(H2-,37,39,41,42) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5cccc6c5cccc6)c7ccc(cc7)C(F)(F)F)N | |
| AKOS005253777 | 606.598 | C33 H20 F2 N4 O4 S | HQDOZXQPBYCEOH-UHFFFAOYSA-N | InChI=1S/C33H20F2N4O4S/c1-42-20-12-10-19(11-13-20)39-29(33(41)43-38-39)30(40)31-28(36)27-24(22-14-9-18(34)15-25(22)35)16-26(37-32(27)44-31)23-8-4-6-17-5-2-3-7-21(17)23/h2-16H,1H3,(H2-,36,38,40,41) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5cccc6c5cccc6)c7ccc(cc7F)F)N | |
| AKOS005253755 | 588.608 | C33 H21 F N4 O4 S | SYRAJMMXOBQMOC-UHFFFAOYSA-N | InChI=1S/C33H21FN4O4S/c1-41-22-14-12-21(13-15-22)38-29(33(40)42-37-38)30(39)31-28(35)27-25(19-8-4-9-20(34)16-19)17-26(36-32(27)43-31)24-11-5-7-18-6-2-3-10-23(18)24/h2-17H,1H3,(H2-,35,37,39,40) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5cccc6c5cccc6)c7cccc(c7)F)N | |
| AKOS005252952 | 554.618 | C33 H22 N4 O3 S | SMEXYYLHTSCJKY-UHFFFAOYSA-N | InChI=1S/C33H22N4O3S/c1-19-14-16-21(17-15-19)25-18-26(24-13-7-9-20-8-5-6-12-23(20)24)35-32-27(25)28(34)31(41-32)30(38)29-33(39)40-36-37(29)22-10-3-2-4-11-22/h2-18H,1H3,(H2-,34,36,38,39) | Cc1ccc(cc1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6cccc7c6cccc7 | |
| AKOS005252953 | 570.617 | C33 H22 N4 O4 S | LARONGDDYDUORT-UHFFFAOYSA-N | InChI=1S/C33H22N4O4S/c1-40-22-16-14-20(15-17-22)25-18-26(24-13-7-9-19-8-5-6-12-23(19)24)35-32-27(25)28(34)31(42-32)30(38)29-33(39)41-36-37(29)21-10-3-2-4-11-21/h2-18H,1H3,(H2-,34,36,38,39) | COc1ccc(cc1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6cccc7c6cccc7 | |
| AKOS005253694 | 570.617 | C33 H22 N4 O4 S | LDULEMPBSQPMSO-UHFFFAOYSA-N | InChI=1S/C33H22N4O4S/c1-40-22-16-14-21(15-17-22)37-29(33(39)41-36-37)30(38)31-28(34)27-25(20-8-3-2-4-9-20)18-26(35-32(27)42-31)24-13-7-11-19-10-5-6-12-23(19)24/h2-18H,1H3,(H2-,34,36,38,39) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5cccc6c5cccc6)c7ccccc7)N | |
| AKOS005250820 | 588.632 | C33 H24 N4 O5 S | ASUVNPUGBHRKJL-VFCFBJKWSA-N | InChI=1S/C33H24N4O5S/c38-29(30-32(40)42-35-37(30)26-14-8-3-9-15-26)22-43-33-34-28(31(39)36(33)25-12-6-2-7-13-25)20-23-16-18-27(19-17-23)41-21-24-10-4-1-5-11-24/h1-20H,21-22H2/b28-20+ | c1ccc(cc1)COc2ccc(cc2)/C=C/3\C(=O)N(C(=N3)SCC(=O)c4c(on[n+]4c5ccccc5)[O-])c6ccccc6 | |
| AKOS005253968 | 651.758 | C33 H29 N7 O4 S2 | CZPUZCOWAWAAGZ-UHFFFAOYSA-N | InChI=1S/C33H29N7O4S2/c1-19-8-15-24-27(16-19)46-31(35-24)21-9-11-22(12-10-21)34-28(41)17-25-32(43)40(23-13-14-23)33(45)39(25)18-26-30(44-37-38(26)2)36-29(42)20-6-4-3-5-7-20/h3-12,15-16,23,25H,13-14,17-18H2,1-2H3,(H-,34,35,36,37,41,42) | Cc1ccc2c(c1)sc(n2)c3ccc(cc3)NC(=O)CC4C(=O)N(C(=S)N4Cc5c(on[n+]5C)[N-]C(=O)c6ccccc6)C7CC7 | |
| AKOS005253966 | 606.694 | C33 H30 N6 O4 S | GZLFZLAATZQHGT-OUKQBFOZSA-N | InChI=1S/C33H30N6O4S/c1-37-28(31(43-36-37)35-30(41)24-10-6-3-7-11-24)21-38-27(32(42)39(33(38)44)26-18-19-26)20-29(40)34-25-16-14-23(15-17-25)13-12-22-8-4-2-5-9-22/h2-17,26-27H,18-21H2,1H3,(H-,34,35,36,40,41)/b13-12+ | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)/C=C/c6ccccc6 | |
| AKOS005254168 | 701.838 | C33 H31 N7 O5 S3 | DVIOJAJRLHMARK-UHFFFAOYSA-N | InChI=1S/C33H31N7O5S3/c1-19-4-13-24(14-5-19)48(43,44)36-30-27(38(3)37-45-30)18-39-26(32(42)40(33(39)46)23-11-12-23)17-29(41)34-22-9-7-21(8-10-22)31-35-25-15-6-20(2)16-28(25)47-31/h4-10,13-16,23,26H,11-12,17-18H2,1-3H3,(H-,34,35,36,37,41) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)c6nc7ccc(cc7s6)C | |
| AKOS005254166 | 656.774 | C33 H32 N6 O5 S2 | CLYPWPLDAKTJDU-ZHACJKMWSA-N | InChI=1S/C33H32N6O5S2/c1-22-8-18-27(19-9-22)46(42,43)35-31-29(37(2)36-44-31)21-38-28(32(41)39(33(38)45)26-16-17-26)20-30(40)34-25-14-12-24(13-15-25)11-10-23-6-4-3-5-7-23/h3-15,18-19,26,28H,16-17,20-21H2,1-2H3,(H-,34,35,36,40)/b11-10+ | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)C4CC4)CC(=O)Nc5ccc(cc5)/C=C/c6ccccc6 | |
| AKOS005254024 | 656.708 | C33 H32 N6 O7 S | BAJYUVQGIGIKQS-UHFFFAOYSA-N | InChI=1S/C33H32N6O7S/c1-4-44-25-17-15-24(16-18-25)39-31(42)26(19-28(40)34-23-13-11-22(12-14-23)32(43)45-5-2)38(33(39)47)20-27-30(46-36-37(27)3)35-29(41)21-9-7-6-8-10-21/h6-18,26H,4-5,19-20H2,1-3H3,(H-,34,35,36,40,41,43) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)C(=O)OCC | |
| AKOS005254101 | 674.79 | C33 H34 N6 O6 S2 | YNBMFYWWCWIOTH-UHFFFAOYSA-N | InChI=1S/C33H34N6O6S2/c1-20(2)39-27(31(45-37-39)36-47(42,43)25-12-5-21(3)6-13-25)19-38-15-16-44-28(33(38)41)18-30(40)34-24-10-8-23(9-11-24)32-35-26-14-7-22(4)17-29(26)46-32/h5-14,17,20,28H,15-16,18-19H2,1-4H3,(H-,34,35,36,37,40) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)c5nc6ccc(cc6s5)C | |
| AKOS005254051 | 706.788 | C33 H34 N6 O8 S2 | QBKBKMZHKNIBPJ-UHFFFAOYSA-N | InChI=1S/C33H34N6O8S2/c1-5-45-25-15-13-24(14-16-25)39-31(41)27(19-29(40)34-23-11-9-22(10-12-23)32(42)46-6-2)38(33(39)48)20-28-30(47-36-37(28)4)35-49(43,44)26-17-7-21(3)8-18-26/h7-18,27H,5-6,19-20H2,1-4H3,(H-,34,35,36,40,42) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)C(=O)OCC | |
| AKOS005254099 | 629.726 | C33 H35 N5 O6 S | GSWGKXHCTQTDBB-VAWYXSNFSA-N | InChI=1S/C33H35N5O6S/c1-23(2)38-29(32(44-36-38)35-45(41,42)28-17-9-24(3)10-18-28)22-37-19-20-43-30(33(37)40)21-31(39)34-27-15-13-26(14-16-27)12-11-25-7-5-4-6-8-25/h4-18,23,30H,19-22H2,1-3H3,(H-,34,35,36,39)/b12-11+ | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C(C)C)CN3CCOC(C3=O)CC(=O)Nc4ccc(cc4)/C=C/c5ccccc5 | |
| AKOS005253751 | 638.615 | C34 H21 F3 N4 O4 S | MEEUWDMFJVOTCI-UHFFFAOYSA-N | InChI=1S/C34H21F3N4O4S/c1-44-22-15-13-21(14-16-22)41-29(33(43)45-40-41)30(42)31-28(38)27-25(19-9-11-20(12-10-19)34(35,36)37)17-26(39-32(27)46-31)24-8-4-6-18-5-2-3-7-23(18)24/h2-17H,1H3,(H2-,38,40,42,43) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5cccc6c5cccc6)c7ccc(cc7)C(F)(F)F)N | |
| AKOS005253691 | 584.644 | C34 H24 N4 O4 S | RCAWDIKEXQCLMF-UHFFFAOYSA-N | InChI=1S/C34H24N4O4S/c1-19-10-12-21(13-11-19)26-18-27(25-9-5-7-20-6-3-4-8-24(20)25)36-33-28(26)29(35)32(43-33)31(39)30-34(40)42-37-38(30)22-14-16-23(41-2)17-15-22/h3-18H,1-2H3,(H2-,35,37,39,40) | Cc1ccc(cc1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N)c6cccc7c6cccc7 | |
| AKOS005253688 | 600.643 | C34 H24 N4 O5 S | AOPUYCLWMVOKLA-UHFFFAOYSA-N | InChI=1S/C34H24N4O5S/c1-41-21-15-16-24(27(17-21)42-2)25-18-26(23-14-8-10-19-9-6-7-13-22(19)23)36-33-28(25)29(35)32(44-33)31(39)30-34(40)43-37-38(30)20-11-4-3-5-12-20/h3-18H,1-2H3,(H2-,35,37,39,40) | COc1ccc(c(c1)OC)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccccc5)[O-])N)c6cccc7c6cccc7 | |
| AKOS005253693 | 600.643 | C34 H24 N4 O5 S | WPDVDEMXNYMYIL-UHFFFAOYSA-N | InChI=1S/C34H24N4O5S/c1-41-22-14-10-20(11-15-22)26-18-27(25-9-5-7-19-6-3-4-8-24(19)25)36-33-28(26)29(35)32(44-33)31(39)30-34(40)43-37-38(30)21-12-16-23(42-2)17-13-21/h3-18H,1-2H3,(H2-,35,37,39,40) | COc1ccc(cc1)c2cc(nc3c2c(c(s3)C(=O)c4c(on[n+]4c5ccc(cc5)OC)[O-])N)c6cccc7c6cccc7 | |
| AKOS005250862 | 618.658 | C34 H26 N4 O6 S | SUZWLQPUIRBUAU-ZTKZIYFRSA-N | InChI=1S/C34H26N4O6S/c1-42-27-18-14-26(15-19-27)38-31(33(41)44-36-38)30(39)22-45-34-35-29(32(40)37(34)25-10-6-3-7-11-25)20-23-12-16-28(17-13-23)43-21-24-8-4-2-5-9-24/h2-20H,21-22H2,1H3/b29-20+ | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)CSC3=N/C(=C/c4ccc(cc4)OCc5ccccc5)/C(=O)N3c6ccccc6 | |
| AKOS005253734 | 630.669 | C35 H26 N4 O6 S | BAEJWSPFBSEVDX-UHFFFAOYSA-N | InChI=1S/C35H26N4O6S/c1-42-21-13-11-20(12-14-21)39-31(35(41)45-38-39)32(40)33-30(36)29-26(25-16-15-22(43-2)17-28(25)44-3)18-27(37-34(29)46-33)24-10-6-8-19-7-4-5-9-23(19)24/h4-18H,1-3H3,(H2-,36,38,40,41) | COc1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)c3c(c4c(cc(nc4s3)c5cccc6c5cccc6)c7ccc(cc7OC)OC)N | |
| AKOS005253951 | 657.698 | C35 H27 N7 O5 S | YJDWFZMGWYCZRN-UHFFFAOYSA-N | InChI=1S/C35H27N7O5S/c1-40-28(33(47-39-40)38-31(44)22-10-4-2-5-11-22)21-41-27(34(45)42(35(41)48)25-12-6-3-7-13-25)20-30(43)36-24-18-16-23(17-19-24)32-37-26-14-8-9-15-29(26)46-32/h2-19,27H,20-21H2,1H3,(H-,36,37,38,39,43,44) | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)c6nc7ccccc7o6 | |
| AKOS005254148 | 707.778 | C35 H29 N7 O6 S2 | NDUMXLXSAOXGJK-UHFFFAOYSA-N | InChI=1S/C35H29N7O6S2/c1-22-12-18-26(19-13-22)50(45,46)38-33-29(40(2)39-48-33)21-41-28(34(44)42(35(41)49)25-8-4-3-5-9-25)20-31(43)36-24-16-14-23(15-17-24)32-37-27-10-6-7-11-30(27)47-32/h3-19,28H,20-21H2,1-2H3,(H-,36,37,38,39,43) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)c6nc7ccccc7o6 | |
| AKOS005253952 | 687.79 | C36 H29 N7 O4 S2 | TYFSXDLYALYXLU-UHFFFAOYSA-N | InChI=1S/C36H29N7O4S2/c1-22-13-18-27-30(19-22)49-34(38-27)24-14-16-25(17-15-24)37-31(44)20-28-35(46)43(26-11-7-4-8-12-26)36(48)42(28)21-29-33(47-40-41(29)2)39-32(45)23-9-5-3-6-10-23/h3-19,28H,20-21H2,1-2H3,(H-,37,38,39,40,44,45) | Cc1ccc2c(c1)sc(n2)c3ccc(cc3)NC(=O)CC4C(=O)N(C(=S)N4Cc5c(on[n+]5C)[N-]C(=O)c6ccccc6)c7ccccc7 | |
| AKOS005253984 | 671.724 | C36 H29 N7 O5 S | IMULLXJABJYFGO-UHFFFAOYSA-N | InChI=1S/C36H29N7O5S/c1-22-12-18-26(19-13-22)43-35(46)28(20-31(44)37-25-16-14-24(15-17-25)33-38-27-10-6-7-11-30(27)47-33)42(36(43)49)21-29-34(48-40-41(29)2)39-32(45)23-8-4-3-5-9-23/h3-19,28H,20-21H2,1-2H3,(H-,37,38,39,40,44,45) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)c6nc7ccccc7o6 | |
| AKOS005253950 | 642.726 | C36 H30 N6 O4 S | LDKOFPKBCJEULJ-ISLYRVAYSA-N | InChI=1S/C36H30N6O4S/c1-40-31(34(46-39-40)38-33(44)27-13-7-3-8-14-27)24-41-30(35(45)42(36(41)47)29-15-9-4-10-16-29)23-32(43)37-28-21-19-26(20-22-28)18-17-25-11-5-2-6-12-25/h2-22,30H,23-24H2,1H3,(H-,37,38,39,43,44)/b18-17+ | C[n+]1c(c(on1)[N-]C(=O)c2ccccc2)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)/C=C/c6ccccc6 | |
| AKOS005254149 | 737.87 | C36 H31 N7 O5 S3 | LWRDJCZOWBYVDO-UHFFFAOYSA-N | InChI=1S/C36H31N7O5S3/c1-22-9-16-27(17-10-22)51(46,47)39-33-30(41(3)40-48-33)21-42-29(35(45)43(36(42)49)26-7-5-4-6-8-26)20-32(44)37-25-14-12-24(13-15-25)34-38-28-18-11-23(2)19-31(28)50-34/h4-19,29H,20-21H2,1-3H3,(H-,37,38,39,40,44) | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)c6nc7ccc(cc7s6)C | |
| AKOS005254073 | 721.805 | C36 H31 N7 O6 S2 | XFSQUWHTAJATFF-UHFFFAOYSA-N | InChI=1S/C36H31N7O6S2/c1-22-8-16-26(17-9-22)43-35(45)29(20-32(44)37-25-14-12-24(13-15-25)33-38-28-6-4-5-7-31(28)48-33)42(36(43)50)21-30-34(49-40-41(30)3)39-51(46,47)27-18-10-23(2)11-19-27/h4-19,29H,20-21H2,1-3H3,(H-,37,38,39,40,44) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)c6nc7ccccc7o6 | |
| AKOS005254147 | 692.806 | C36 H32 N6 O5 S2 | MEEHXPUONMFGFY-FOCLMDBBSA-N | InChI=1S/C36H32N6O5S2/c1-25-13-21-30(22-14-25)49(45,46)38-34-32(40(2)39-47-34)24-41-31(35(44)42(36(41)48)29-11-7-4-8-12-29)23-33(43)37-28-19-17-27(18-20-28)16-15-26-9-5-3-6-10-26/h3-22,31H,23-24H2,1-2H3,(H-,37,38,39,43)/b16-15+ | Cc1ccc(cc1)S(=O)(=O)[N-]c2c([n+](no2)C)CN3C(C(=O)N(C3=S)c4ccccc4)CC(=O)Nc5ccc(cc5)/C=C/c6ccccc6 | |
| AKOS005253985 | 701.817 | C37 H31 N7 O4 S2 | OCQPIXQJKMAOJD-UHFFFAOYSA-N | InChI=1S/C37H31N7O4S2/c1-22-9-16-27(17-10-22)44-36(47)29(43(37(44)49)21-30-34(48-41-42(30)3)40-33(46)24-7-5-4-6-8-24)20-32(45)38-26-14-12-25(13-15-26)35-39-28-18-11-23(2)19-31(28)50-35/h4-19,29H,20-21H2,1-3H3,(H-,38,39,40,41,45,46) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)c6nc7ccc(cc7s6)C | |
| AKOS005254027 | 701.75 | C37 H31 N7 O6 S | BQCKWTQPAWHGGP-UHFFFAOYSA-N | InChI=1S/C37H31N7O6S/c1-3-48-27-19-17-26(18-20-27)44-36(47)29(21-32(45)38-25-15-13-24(14-16-25)34-39-28-11-7-8-12-31(28)49-34)43(37(44)51)22-30-35(50-41-42(30)2)40-33(46)23-9-5-4-6-10-23/h4-20,29H,3,21-22H2,1-2H3,(H-,38,39,40,41,45,46) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)c6nc7ccccc7o6 | |
| AKOS005253983 | 656.753 | C37 H32 N6 O4 S | NHILGBHBFHVDGH-FOCLMDBBSA-N | InChI=1S/C37H32N6O4S/c1-25-13-21-30(22-14-25)43-36(46)31(23-33(44)38-29-19-17-27(18-20-29)16-15-26-9-5-3-6-10-26)42(37(43)48)24-32-35(47-40-41(32)2)39-34(45)28-11-7-4-8-12-28/h3-22,31H,23-24H2,1-2H3,(H-,38,39,40,44,45)/b16-15+ | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)/C=C/c6ccccc6 | |
| AKOS005254074 | 751.897 | C37 H33 N7 O5 S3 | HMEQDGSUKDTFCJ-UHFFFAOYSA-N | InChI=1S/C37H33N7O5S3/c1-22-5-14-27(15-6-22)44-36(46)30(20-33(45)38-26-12-10-25(11-13-26)35-39-29-18-9-24(3)19-32(29)51-35)43(37(44)50)21-31-34(49-41-42(31)4)40-52(47,48)28-16-7-23(2)8-17-28/h5-19,30H,20-21H2,1-4H3,(H-,38,39,40,41,45) | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)c6nc7ccc(cc7s6)C | |
| AKOS005254054 | 751.831 | C37 H33 N7 O7 S2 | XZVYGLHTGNQKSQ-UHFFFAOYSA-N | InChI=1S/C37H33N7O7S2/c1-4-49-27-17-15-26(16-18-27)44-36(46)30(21-33(45)38-25-13-11-24(12-14-25)34-39-29-7-5-6-8-32(29)50-34)43(37(44)52)22-31-35(51-41-42(31)3)40-53(47,48)28-19-9-23(2)10-20-28/h5-20,30H,4,21-22H2,1-3H3,(H-,38,39,40,41,45) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)c6nc7ccccc7o6 | |
| AKOS005254072 | 706.833 | C37 H34 N6 O5 S2 | RZWDIILDADWGRH-BUHFOSPRSA-N | InChI=1S/C37H34N6O5S2/c1-25-9-19-30(20-10-25)43-36(45)32(23-34(44)38-29-17-15-28(16-18-29)14-13-27-7-5-4-6-8-27)42(37(43)49)24-33-35(48-40-41(33)3)39-50(46,47)31-21-11-26(2)12-22-31/h4-22,32H,23-24H2,1-3H3,(H-,38,39,40,44)/b14-13+ | Cc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)/C=C/c6ccccc6 | |
| AKOS005254028 | 731.843 | C38 H33 N7 O5 S2 | YJWRIRPEQJYJHQ-UHFFFAOYSA-N | InChI=1S/C38H33N7O5S2/c1-4-49-28-17-15-27(16-18-28)45-37(48)30(44(38(45)51)22-31-35(50-42-43(31)3)41-34(47)24-8-6-5-7-9-24)21-33(46)39-26-13-11-25(12-14-26)36-40-29-19-10-23(2)20-32(29)52-36/h5-20,30H,4,21-22H2,1-3H3,(H-,39,40,41,42,46,47) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)c6nc7ccc(cc7s6)C | |
| AKOS005254026 | 686.779 | C38 H34 N6 O5 S | VFPMYRKYEDBZLJ-CCEZHUSRSA-N | InChI=1S/C38H34N6O5S/c1-3-48-31-22-20-30(21-23-31)44-37(47)32(24-34(45)39-29-18-16-27(17-19-29)15-14-26-10-6-4-7-11-26)43(38(44)50)25-33-36(49-41-42(33)2)40-35(46)28-12-8-5-9-13-28/h4-23,32H,3,24-25H2,1-2H3,(H-,39,40,41,45,46)/b15-14+ | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]C(=O)c4ccccc4)CC(=O)Nc5ccc(cc5)/C=C/c6ccccc6 | |
| AKOS005254055 | 781.923 | C38 H35 N7 O6 S3 | VTUXVJRQZGQSAX-UHFFFAOYSA-N | InChI=1S/C38H35N7O6S3/c1-5-50-28-15-13-27(14-16-28)45-37(47)31(21-34(46)39-26-11-9-25(10-12-26)36-40-30-19-8-24(3)20-33(30)53-36)44(38(45)52)22-32-35(51-42-43(32)4)41-54(48,49)29-17-6-23(2)7-18-29/h6-20,31H,5,21-22H2,1-4H3,(H-,39,40,41,42,46) | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)c6nc7ccc(cc7s6)C | |
| AKOS005254053 | 736.859 | C38 H36 N6 O6 S2 | QGGPKPFEDSCCCL-OUKQBFOZSA-N | InChI=1S/C38H36N6O6S2/c1-4-49-31-20-18-30(19-21-31)44-37(46)33(24-35(45)39-29-16-14-28(15-17-29)13-12-27-8-6-5-7-9-27)43(38(44)51)25-34-36(50-41-42(34)3)40-52(47,48)32-22-10-26(2)11-23-32/h5-23,33H,4,24-25H2,1-3H3,(H-,39,40,41,45)/b13-12+ | CCOc1ccc(cc1)N2C(=O)C(N(C2=S)Cc3c(on[n+]3C)[N-]S(=O)(=O)c4ccc(cc4)C)CC(=O)Nc5ccc(cc5)/C=C/c6ccccc6 | |
| AKOS005214191 | 128.086 | C4 H4 N2 O3 | GZNLAFLHAXNSKR-UHFFFAOYSA-N | InChI=1S/C4H4N2O3/c1-6-3(2-7)4(8)9-5-6/h2H,1H3 | C[n+]1c(c(on1)[O-])C=O | |
| AKOS005214205 | 144.086 | C4 H4 N2 O4 | XHYMGVYSSVQNHP-UHFFFAOYSA-N | InChI=1S/C4H4N2O4/c7-3(8)1-6-2-4(9)10-5-6/h2H,1H2,(H-,5,7,8,9) | c1c(on[n+]1CC(=O)O)[O-] | MFCD08059712 |
| AKOS005219764 | 144.086 | C4 H4 N2 O4 | AEMGNFFBWNPCAR-UHFFFAOYSA-N | InChI=1S/C4H4N2O4/c1-6-2(3(7)8)4(9)10-5-6/h1H3,(H-,5,7,8,9) | C[n+]1c(c(on1)[O-])C(=O)O | |
| AKOS005215739 | 148.548 | C4 H5 Cl N2 O2 | AJJNSCVUWLOGMU-UHFFFAOYSA-N | InChI=1S/C4H5ClN2O2/c1-7-3(2-5)4(8)9-6-7/h2H2,1H3 | C[n+]1c(c(on1)[O-])CCl | |
| AKOS005215599 | 143.101 | C4 H5 N3 O3 | VONVEAFKQNTZRI-UHFFFAOYSA-O | InChI=1S/C4H4N3O3/c1-7-3(2-5-9)4(8)10-6-7/h2H,1H3/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=N/O | |
| AKOS005253388 | 160.562 | C4 H5 N4 O . Cl | FCQAGFXWEOLRTJ-UHFFFAOYSA-M | InChI=1S/C4H5N4O.ClH/c5-1-2-8-3-4(6)9-7-8;/h3H,2,6H2;1H/q+1;/p-1 | c1c(on[n+]1CC#N)N.[Cl-] | |
| AKOS005251315 | 146.168 | C4 H6 N2 O2 S | QPNZBQUFNOVAFZ-UHFFFAOYSA-N | InChI=1S/C4H6N2O2S/c1-6-3(9-2)4(7)8-5-6/h1-2H3 | C[n+]1c(c(on1)[O-])SC | |
| AKOS005219765 | 130.102 | C4 H6 N2 O3 | WTRHSJYKWMKDNH-UHFFFAOYSA-N | InChI=1S/C4H6N2O3/c1-6-3(2-7)4(8)9-5-6/h7H,2H2,1H3 | C[n+]1c(c(on1)[O-])CO | |
| AKOS005252566 | 113.118 | C4 H7 N3 O | NCIGWPHMDJUFHR-UHFFFAOYSA-N | InChI=1S/C4H7N3O/c1-2-7-3-4(5)8-6-7/h3,5H,2H2,1H3 | CC[n+]1cc(on1)[NH-] | |
| AKOS005214216 | 129.117 | C4 H7 N3 O2 | MXTKHWLWCCMMGZ-UHFFFAOYSA-N | InChI=1S/C4H7N3O2/c1-7-3(2-5)4(8)9-6-7/h2,5H2,1H3 | C[n+]1c(c(on1)[O-])CN | |
| AKOS005215718 | 149.579 | C4 H8 N3 O . Cl | GSOHYOBUFVCQDP-UHFFFAOYSA-M | InChI=1S/C4H8N3O.ClH/c1-2-7-3-4(5)8-6-7;/h3H,2,5H2,1H3;1H/q+1;/p-1 | CC[n+]1cc(on1)N.[Cl-] | |
| AKOS005252568 | 128.133 | C4 H8 N4 O | YBOQSVRDMSNIOX-UHFFFAOYSA-N | InChI=1S/C4H8N4O/c1-7(2)8-3-4(5)9-6-8/h3,5H,1-2H3 | CN(C)[n+]1cc(on1)[NH-] | |
| AKOS005215731 | 164.593 | C4 H9 N4 O . Cl | HUGANTMXIYFMCP-UHFFFAOYSA-M | InChI=1S/C4H9N4O.ClH/c1-7(2)8-3-4(5)9-6-8;/h3H,5H2,1-2H3;1H/q+1;/p-1 | CN(C)[n+]1cc(on1)N.[Cl-] | MFCD09881684 |
| AKOS005215717 | 163.605 | C5 H10 N3 O . Cl | VWFKBBVQLMSINJ-UHFFFAOYSA-M | InChI=1S/C5H10N3O.ClH/c1-4(2)8-3-5(6)9-7-8;/h3-4H,6H2,1-2H3;1H/q+1;/p-1 | CC(C)[n+]1cc(on1)N.[Cl-] | MFCD09881635 |
| AKOS005219463 | 179.605 | C5 H10 N3 O2 . Cl | ZADKNCZVTKKSPS-UHFFFAOYSA-M | InChI=1S/C5H10N3O2.ClH/c1-9-3-2-8-4-5(6)10-7-8;/h4H,2-3,6H2,1H3;1H/q+1;/p-1 | COCC[n+]1cc(on1)N.[Cl-] | |
| AKOS005251330 | 171.177 | C5 H5 N3 O2 S | DSVUVSJORSWHQS-UHFFFAOYSA-N | InChI=1S/C5H5N3O2S/c1-8-4(11-3-2-6)5(9)10-7-8/h3H2,1H3 | C[n+]1c(c(on1)[O-])SCC#N | |
| AKOS005215654 | 175.573 | C5 H6 Cl N3 O2 | QJIXVMHBQRJYHC-UHFFFAOYSA-N | InChI=1S/C5H6ClN3O2/c1-9-3-5(11-8-9)7-4(10)2-6/h3H,2H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CCl | |
| AKOS005251316 | 190.177 | C5 H6 N2 O4 S | KJOLEFAPLOKGSJ-UHFFFAOYSA-N | InChI=1S/C5H6N2O4S/c1-7-4(5(10)11-6-7)12-2-3(8)9/h2H2,1H3,(H-,6,8,9,10) | C[n+]1c(c(on1)[O-])SCC(=O)O | |
| AKOS003578181 | 141.128 | C5 H7 N3 O2 | UCTKNRPDWKUAGL-UHFFFAOYSA-N | InChI=1S/C5H7N3O2/c1-4(9)6-5-3-8(2)7-10-5/h3H,1-2H3 | CC(=O)[N-]c1c[n+](no1)C | MFCD03211600 |
| AKOS005251321 | 189.192 | C5 H7 N3 O3 S | BADSVUGKNWXHQU-UHFFFAOYSA-N | InChI=1S/C5H7N3O3S/c1-8-4(5(10)11-7-8)12-2-3(6)9/h2H2,1H3,(H2-,6,7,9,10) | C[n+]1c(c(on1)[O-])SCC(=O)N | |
| AKOS005219758 | 201.206 | C5 H7 N5 O2 S | JNFXKKLMNHHJKX-UHFFFAOYSA-O | InChI=1S/C5H6N5O2S/c1-10-3(4(11)12-9-10)2-7-8-5(6)13/h2H,1H3,(H2,6,13)/q-1/p+1 | C[n+]1c(c(on1)[O-])/C=N/NC(=S)N | |
| AKOS005215563 | 161.59 | C5 H8 N3 O . Cl | ITJMIIZULAMTOO-UHFFFAOYSA-M | InChI=1S/C5H8N3O.ClH/c1-2-3-8-4-5(6)9-7-8;/h2,4H,1,3,6H2;1H/q+1;/p-1 | C=CC[n+]1cc(on1)N.[Cl-] | |
| AKOS005215732 | 161.59 | C5 H8 N3 O . Cl | XPKAKPMRRGRMIS-UHFFFAOYSA-M | InChI=1S/C5H8N3O.ClH/c6-5-3-8(7-9-5)4-1-2-4;/h3-4H,1-2,6H2;1H/q+1;/p-1 | c1c(on[n+]1C2CC2)N.[Cl-] | |
| AKOS005252567 | 127.144 | C5 H9 N3 O | PLIFLEVBVVPNLI-UHFFFAOYSA-N | InChI=1S/C5H9N3O/c1-4(2)8-3-5(6)9-7-8/h3-4,6H,1-2H3 | CC(C)[n+]1cc(on1)[NH-] | |
| AKOS005219449 | 143.144 | C5 H9 N3 O2 | QRDTVNIPPKLPHO-UHFFFAOYSA-N | InChI=1S/C5H9N3O2/c1-6-3-4-5(9)10-7-8(4)2/h6H,3H2,1-2H3 | CNCc1c(on[n+]1C)[O-] | |
| AKOS005252589 | 143.144 | C5 H9 N3 O2 | BEYVUIGINRUCDK-UHFFFAOYSA-N | InChI=1S/C5H9N3O2/c1-9-3-2-8-4-5(6)10-7-8/h4,6H,2-3H2,1H3 | COCC[n+]1cc(on1)[NH-] | |
| AKOS005215685 | 179.605 | C5 H9 N3 O2 . Cl H | XWMPRSGXDUKSLR-UHFFFAOYSA-N | InChI=1S/C5H9N3O2.ClH/c1-6-3-4-5(9)10-7-8(4)2;/h6H,3H2,1-2H3;1H | CNCc1c(on[n+]1C)[O-].Cl | |
| AKOS005215033 | 170.169 | C6 H10 N4 O2 | NWKPVMGIJCLASO-UHFFFAOYSA-N | InChI=1S/C6H10N4O2/c1-4(11)8-6-5(3-7)10(2)9-12-6/h3,7H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)C)CN | |
| AKOS005215723 | 170.169 | C6 H10 N4 O2 | ZBPITQUNRILKSW-UHFFFAOYSA-N | InChI=1S/C6H10N4O2/c1-5(11)7-6-4-10(8-12-6)9(2)3/h4H,1-3H3 | CC(=O)[N-]c1c[n+](no1)N(C)C | |
| AKOS005252588 | 170.169 | C6 H10 N4 O2 | FKDHHVKWGRFRTG-UHFFFAOYSA-N | InChI=1S/C6H10N4O2/c7-6-5-10(8-12-6)9-1-3-11-4-2-9/h5,7H,1-4H2 | c1c(on[n+]1N2CCOCC2)[NH-] | |
| AKOS005215440 | 256.528 | C6 H11 Br N3 O . Cl | HCDZNEADKJYMRP-UHFFFAOYSA-M | InChI=1S/C6H11BrN3O.ClH/c1-2-3-4-10-5(7)6(8)11-9-10;/h2-4,8H2,1H3;1H/q+1;/p-1 | CCCC[n+]1c(c(on1)N)Br.[Cl-] | MFCD09881678 |
| AKOS001688957 | 141.171 | C6 H11 N3 O | ZYRXTFQJXOMBOD-UHFFFAOYSA-N | InChI=1S/C6H11N3O/c1-2-3-4-9-5-6(7)10-8-9/h5,7H,2-4H2,1H3 | CCCC[n+]1cc(on1)[NH-] | MFCD04539026 |
| AKOS003279217 | 176.624 | C6 H11 N3 O . Cl | ZTRGDTFKPJWORF-UHFFFAOYSA-M | InChI=1S/C6H11N3O.ClH/c1-2-3-4-9-5-6(7)10-8-9;/h5,7H,2-4H2,1H3;1H/p-1 | CCCC[n+]1cc(on1)[NH-].[Cl-] | |
| AKOS000491268 | 177.632 | C6 H11 N3 O . Cl H | ZTRGDTFKPJWORF-UHFFFAOYSA-N | InChI=1S/C6H11N3O.ClH/c1-2-3-4-9-5-6(7)10-8-9;/h5,7H,2-4H2,1H3;1H | CCCC[n+]1cc(on1)[NH-].Cl | MFCD03130860 |
| AKOS005214217 | 157.17 | C6 H11 N3 O2 | MZQMJVWYEGAWLP-UHFFFAOYSA-N | InChI=1S/C6H11N3O2/c1-4(2)9-5(3-7)6(10)11-8-9/h4H,3,7H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CN | |
| AKOS005214166 | 173.17 | C6 H11 N3 O3 | YURRKSYRTXZPIW-UHFFFAOYSA-N | InChI=1S/C6H11N3O3/c1-9-5(4-7-2-3-10)6(11)12-8-9/h7,10H,2-4H2,1H3 | C[n+]1c(c(on1)[O-])CNCCO | |
| AKOS005166851 | 206.63 | C6 H11 N4 O2 . Cl | ZRFWHHCXSSACAW-UHFFFAOYSA-M | InChI=1S/C6H11N4O2.ClH/c7-6-5-10(8-12-6)9-1-3-11-4-2-9;/h5H,1-4,7H2;1H/q+1;/p-1 | c1c(on[n+]1N2CCOCC2)N.[Cl-] | MFCD08705735 |
| AKOS001746345 | 142.179 | C6 H12 N3 O | HMIRQNJERSQUED-UHFFFAOYSA-N | InChI=1S/C6H12N3O/c1-2-3-4-9-5-6(7)10-8-9/h5H,2-4,7H2,1H3/q+1 | CCCC[n+]1cc(on1)N | MFCD00466020 |
| AKOS005215409 | 177.632 | C6 H12 N3 O . Cl | XYTTURHXZMSGAP-UHFFFAOYSA-M | InChI=1S/C6H12N3O.ClH/c1-2-3-4-9-5-6(7)10-8-9;/h5H,2-4,7H2,1H3;1H/q+1;/p-1 | CCCC[n+]1cc(on1)N.[Cl-] | |
| AKOS005252564 | 215.253 | C6 H5 N3 O2 S2 | CORJYZORXIOFSK-UHFFFAOYSA-N | InChI=1S/C6H5N3O2S2/c1-9-4(5(10)11-8-9)3-2-13-6(12)7-3/h2H,1H3,(H-,7,8,10,12) | C[n+]1c(c(on1)[O-])c2csc(n2)S | |
| AKOS005252636 | 234.663 | C6 H6 N4 O2 S . Cl H | UVJSUEVUFGHHSY-UHFFFAOYSA-N | InChI=1S/C6H6N4O2S.ClH/c1-10-4(5(11)12-9-10)3-2-13-6(7)8-3;/h2H,1H3,(H2-,7,8,9,11);1H | C[n+]1c(c(on1)[O-])c2csc(n2)N.Cl | |
| AKOS005215640 | 169.138 | C6 H7 N3 O3 | DTFKFAFIGMIUGN-UHFFFAOYSA-N | InChI=1S/C6H7N3O3/c1-4(11)7-6-5(3-10)9(2)8-12-6/h3H,1-2H3 | CC(=O)[N-]c1c([n+](no1)C)C=O | |
| AKOS005214950 | 189.6 | C6 H8 Cl N3 O2 | BAVMORUXXQTFTP-UHFFFAOYSA-N | InChI=1S/C6H8ClN3O2/c1-4(11)8-6-5(3-7)10(2)9-12-6/h3H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)C)CCl | |
| AKOS005215644 | 189.6 | C6 H8 Cl N3 O2 | GGKFDACATDQCDQ-UHFFFAOYSA-N | InChI=1S/C6H8ClN3O2/c1-2-10-4-6(12-9-10)8-5(11)3-7/h4H,2-3H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CCl | |
| AKOS005214201 | 156.139 | C6 H8 N2 O3 | KOWCDXAPOUBDDA-UHFFFAOYSA-N | InChI=1S/C6H8N2O3/c1-4(2)8-5(3-9)6(10)11-7-8/h3-4H,1-2H3 | CC(C)[n+]1c(c(on1)[O-])C=O | |
| AKOS005219733 | 228.232 | C6 H8 N6 O2 S | PTFMJHCXVIQKLW-UHFFFAOYSA-N | InChI=1S/C6H8N6O2S/c1-12-2(4(13)14-11-12)3-8-5(7)10-6(15)9-3/h3H,1H3,(H4-,7,8,9,10,11,13,15) | C[n+]1c(c(on1)[O-])C2NC(=NC(=N2)N)S | |
| AKOS005215657 | 204.614 | C6 H9 Cl N4 O2 | LFQOJOYJEALAOH-UHFFFAOYSA-N | InChI=1S/C6H9ClN4O2/c1-10(2)11-4-6(13-9-11)8-5(12)3-7/h4H,3H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CCl | |
| AKOS005215720 | 155.155 | C6 H9 N3 O2 | PIJIHEDGEIWVAI-UHFFFAOYSA-N | InChI=1S/C6H9N3O2/c1-3-9-4-6(11-8-9)7-5(2)10/h4H,3H2,1-2H3 | CC[n+]1cc(on1)[N-]C(=O)C | |
| AKOS005214895 | 171.154 | C6 H9 N3 O3 | MZLJFNKHJAWRAL-UHFFFAOYSA-N | InChI=1S/C6H9N3O3/c1-4(11)7-6-5(3-10)9(2)8-12-6/h10H,3H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)C)CO | |
| AKOS005215613 | 248.077 | C7 H10 Br N3 O2 | FJBKDJSUUOGXLH-UHFFFAOYSA-N | InChI=1S/C7H10BrN3O2/c1-5(2)11-4-7(13-10-11)9-6(12)3-8/h4-5H,3H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CBr | |
| AKOS005215425 | 264.077 | C7 H10 Br N3 O3 | NRGITMOVXZVXOA-UHFFFAOYSA-N | InChI=1S/C7H10BrN3O3/c1-4(2)11-5(8)6(14-10-11)9-7(12)13-3/h4H,1-3H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)OC)Br | |
| AKOS005214949 | 203.626 | C7 H10 Cl N3 O2 | UWUAYXIRPHJCBY-UHFFFAOYSA-N | InChI=1S/C7H10ClN3O2/c1-3-11-6(4-8)7(13-10-11)9-5(2)12/h3-4H2,1-2H3 | CC[n+]1c(c(on1)[N-]C(=O)C)CCl | |
| AKOS005215643 | 203.626 | C7 H10 Cl N3 O2 | SAJBLFGCWOUSGE-UHFFFAOYSA-N | InChI=1S/C7H10ClN3O2/c1-5(2)11-4-7(13-10-11)9-6(12)3-8/h4-5H,3H2,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CCl | |
| AKOS005251272 | 218.23 | C7 H10 N2 O4 S | IAVUHLLWLXCGDF-UHFFFAOYSA-N | InChI=1S/C7H10N2O4S/c1-3-12-5(10)4-14-6-7(11)13-8-9(6)2/h3-4H2,1-2H3 | CCOC(=O)CSc1c(on[n+]1C)[O-] | |
| AKOS005215652 | 198.179 | C7 H10 N4 O3 | VFKHXAFWLIQXEO-UHFFFAOYSA-N | InChI=1S/C7H10N4O3/c1-5(13)8-7-6(4-12)11(9-14-7)10(2)3/h4H,1-3H3 | CC(=O)[N-]c1c([n+](no1)N(C)C)C=O | |
| AKOS005214963 | 218.641 | C7 H11 Cl N4 O2 | BDUHVNXKLXAAJA-UHFFFAOYSA-N | InChI=1S/C7H11ClN4O2/c1-5(13)9-7-6(4-8)12(10-14-7)11(2)3/h4H2,1-3H3 | CC(=O)[N-]c1c([n+](no1)N(C)C)CCl | |
| AKOS005214229 | 169.181 | C7 H11 N3 O2 | MUNJYSLZKVGNOH-UHFFFAOYSA-N | InChI=1S/C7H11N3O2/c1-10-6(7(11)12-9-10)4-8-5-2-3-5/h5,8H,2-4H2,1H3 | C[n+]1c(c(on1)[O-])CNC2CC2 | |
| AKOS005214254 | 169.181 | C7 H11 N3 O2 | JIUKVSKMRLTGBN-UHFFFAOYSA-N | InChI=1S/C7H11N3O2/c1-3-4-8-5-6-7(11)12-9-10(6)2/h3,8H,1,4-5H2,2H3 | C[n+]1c(c(on1)[O-])CNCC=C | |
| AKOS005215710 | 169.181 | C7 H11 N3 O2 | FCCKOSKYTIDTLE-UHFFFAOYSA-N | InChI=1S/C7H11N3O2/c1-5(2)10-4-7(12-9-10)8-6(3)11/h4-5H,1-3H3 | CC(C)[n+]1cc(on1)[N-]C(=O)C | MFCD09881637 |
| AKOS005215598 | 205.642 | C7 H11 N3 O2 . Cl H | GIVAJXCVZXMKFT-UHFFFAOYSA-N | InChI=1S/C7H11N3O2.ClH/c1-10-6(7(11)12-9-10)4-8-5-2-3-5;/h5,8H,2-4H2,1H3;1H | C[n+]1c(c(on1)[O-])CNC2CC2.Cl | |
| AKOS005214894 | 185.181 | C7 H11 N3 O3 | SLEZDHCBGHCYTB-UHFFFAOYSA-N | InChI=1S/C7H11N3O3/c1-3-10-6(4-11)7(13-9-10)8-5(2)12/h11H,3-4H2,1-2H3 | CC[n+]1c(c(on1)[N-]C(=O)C)CO | |
| AKOS005215001 | 185.181 | C7 H11 N3 O3 | SJFLJCQHXVMDSW-UHFFFAOYSA-N | InChI=1S/C7H11N3O3/c1-4(11)6-7(8-5(2)12)13-9-10(6)3/h4,11H,1-3H3 | CC(c1c(on[n+]1C)[N-]C(=O)C)O | |
| AKOS005215441 | 185.181 | C7 H11 N3 O3 | XGWLMPKEPVEJBU-UHFFFAOYSA-N | InChI=1S/C7H11N3O3/c1-5(2)10-4-6(13-9-10)8-7(11)12-3/h4-5H,1-3H3 | CC(C)[n+]1cc(on1)[N-]C(=O)OC | |
| AKOS005250361 | 185.181 | C7 H11 N3 O3 | KQIOJTVMZQRYFL-UHFFFAOYSA-N | InChI=1S/C7H11N3O3/c1-5(11)9(2)4-6-7(12)13-8-10(6)3/h4H2,1-3H3 | CC(=O)N(C)Cc1c(on[n+]1C)[O-] | |
| AKOS005252569 | 168.196 | C7 H12 N4 O | WNCAUPVVPFCLCG-UHFFFAOYSA-N | InChI=1S/C7H12N4O/c8-7-6-11(9-12-7)10-4-2-1-3-5-10/h6,8H,1-5H2 | c1c(on[n+]1N2CCCCC2)[NH-] | |
| AKOS005214920 | 184.196 | C7 H12 N4 O2 | JMIOITBWUUQJRM-UHFFFAOYSA-N | InChI=1S/C7H12N4O2/c1-5(12)9-7-6(4-8-2)11(3)10-13-7/h8H,4H2,1-3H3 | CC(=O)[N-]c1c([n+](no1)C)CNC | |
| AKOS005215032 | 184.196 | C7 H12 N4 O2 | DDYCVHUTZLUKEJ-UHFFFAOYSA-N | InChI=1S/C7H12N4O2/c1-3-11-6(4-8)7(13-10-11)9-5(2)12/h3-4,8H2,1-2H3 | CC[n+]1c(c(on1)[N-]C(=O)C)CN | |
| AKOS005219882 | 216.261 | C7 H12 N4 O2 S | HCAFXNWSWJMVGW-UHFFFAOYSA-N | InChI=1S/C7H12N4O2S/c1-8-7(14)10(2)4-5-6(12)13-9-11(5)3/h4H2,1-3H3,(H-,8,9,12,14) | CNC(=S)N(C)Cc1c(on[n+]1C)[O-] | |
| AKOS005214910 | 200.195 | C7 H12 N4 O3 | SDLRJTZANDARHA-UHFFFAOYSA-N | InChI=1S/C7H12N4O3/c1-5(13)8-7-6(4-12)11(9-14-7)10(2)3/h12H,4H2,1-3H3 | CC(=O)[N-]c1c([n+](no1)N(C)C)CO | |
| AKOS005219450 | 187.196 | C7 H13 N3 O3 | LHKWKFFQGPUUNA-UHFFFAOYSA-N | InChI=1S/C7H13N3O3/c1-10-6(7(11)13-9-10)5-8-3-4-12-2/h8H,3-5H2,1-2H3 | C[n+]1c(c(on1)[O-])CNCCOC | |
| AKOS005215712 | 223.657 | C7 H13 N3 O3 . Cl H | VAEHSQAFVIQYAV-UHFFFAOYSA-N | InChI=1S/C7H13N3O3.ClH/c1-10-6(7(11)13-9-10)5-8-3-4-12-2;/h8H,3-5H2,1-2H3;1H | C[n+]1c(c(on1)[O-])CNCCOC.Cl | |
| AKOS005215730 | 204.657 | C7 H13 N4 O . Cl | XYCMLVAZEKFEOO-UHFFFAOYSA-M | InChI=1S/C7H13N4O.ClH/c8-7-6-11(9-12-7)10-4-2-1-3-5-10;/h6H,1-5,8H2;1H/q+1;/p-1 | c1c(on[n+]1N2CCCCC2)N.[Cl-] | |
| AKOS005215049 | 199.21 | C7 H13 N5 O2 | HNHXBWRJBKOONC-UHFFFAOYSA-N | InChI=1S/C7H13N5O2/c1-5(13)9-7-6(4-8)12(10-14-7)11(2)3/h4,8H2,1-3H3 | CC(=O)[N-]c1c([n+](no1)N(C)C)CN | |
| AKOS005219752 | 176.132 | C7 H4 N4 O2 | VKRUSAJRMQAGGG-UHFFFAOYSA-N | InChI=1S/C7H4N4O2/c1-11-6(7(12)13-10-11)2-5(3-8)4-9/h2H,1H3 | C[n+]1c(c(on1)[O-])C=C(C#N)C#N | |
| AKOS005215740 | 163.134 | C7 H5 N3 O2 | HFOHTUVVUWUBOG-UHFFFAOYSA-N | InChI=1S/C7H5N3O2/c11-7-5-10(9-12-7)6-2-1-3-8-4-6/h1-5H | c1cc(cnc1)[n+]2cc(on2)[O-] | MFCD09881681 |
| AKOS005252635 | 233.675 | C7 H7 N3 O2 S . Cl H | ZVMUZMKBQBJXBK-UHFFFAOYSA-N | InChI=1S/C7H7N3O2S.ClH/c1-4-8-5(3-13-4)6-7(11)12-9-10(6)2;/h3H,1-2H3;1H | Cc1nc(cs1)c2c(on[n+]2C)[O-].Cl | |
| AKOS005250694 | 273.292 | C7 H7 N5 O3 S2 | AOZMDOGMNKJMQS-UHFFFAOYSA-N | InChI=1S/C7H7N5O3S2/c1-12-4(5(14)15-11-12)3(13)2-16-7-10-9-6(8)17-7/h2H2,1H3,(H2-,8,9,11,13,14) | C[n+]1c(c(on1)[O-])C(=O)CSc2nnc(s2)N | |
| AKOS005215658 | 201.61 | C7 H8 Cl N3 O2 | KBQIZDHVTSFZPQ-UHFFFAOYSA-N | InChI=1S/C7H8ClN3O2/c8-3-6(12)9-7-4-11(10-13-7)5-1-2-5/h4-5H,1-3H2 | c1c(on[n+]1C2CC2)[N-]C(=O)CCl | |
| AKOS005215708 | 201.61 | C7 H8 Cl N3 O2 | CHCITEOPHSZTKU-UHFFFAOYSA-N | InChI=1S/C7H8ClN3O2/c1-2-3-11-5-7(13-10-11)9-6(12)4-8/h2,5H,1,3-4H2 | C=CC[n+]1cc(on1)[N-]C(=O)CCl | |
| AKOS005215326 | 223.153 | C7 H8 F3 N3 O2 | TZTLNBYSDHZLLQ-UHFFFAOYSA-N | InChI=1S/C7H8F3N3O2/c1-4(2)13-3-5(15-12-13)11-6(14)7(8,9)10/h3-4H,1-2H3 | CC(C)[n+]1cc(on1)[N-]C(=O)C(F)(F)F | |
| AKOS005215491 | 239.152 | C7 H8 F3 N3 O3 | OFADGTSNMWVQNP-UHFFFAOYSA-N | InChI=1S/C7H8F3N3O3/c1-15-3-2-13-4-5(16-12-13)11-6(14)7(8,9)10/h4H,2-3H2,1H3 | COCC[n+]1cc(on1)[N-]C(=O)C(F)(F)F | |
| AKOS005250366 | 239.152 | C7 H8 F3 N3 O3 | QXLBGEXQDSGYEM-UHFFFAOYSA-N | InChI=1S/C7H8F3N3O3/c1-12(6(15)7(8,9)10)3-4-5(14)16-11-13(4)2/h3H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)C(F)(F)F | |
| AKOS005252627 | 272.307 | C7 H8 N6 O2 S2 | NCULXFDVZTUYII-UHFFFAOYSA-N | InChI=1S/C7H8N6O2S2/c1-13-2-5(15-12-13)9-4(14)3-16-7-11-10-6(8)17-7/h2H,3H2,1H3,(H2-,8,9,10,12,14) | C[n+]1cc(on1)[N-]C(=O)CSc2nnc(s2)N | |
| AKOS005215594 | 254.167 | C7 H9 F3 N4 O3 | UBECPIFEKIAGIW-UHFFFAOYSA-N | InChI=1S/C7H9F3N4O3/c1-13(2)14-4(3-15)5(17-12-14)11-6(16)7(8,9)10/h15H,3H2,1-2H3 | CN(C)[n+]1c(c(on1)[N-]C(=O)C(F)(F)F)CO | |
| AKOS005215567 | 167.165 | C7 H9 N3 O2 | OICYYDUBRUGJNF-UHFFFAOYSA-N | InChI=1S/C7H9N3O2/c1-3-4-10-5-7(12-9-10)8-6(2)11/h3,5H,1,4H2,2H3 | CC(=O)[N-]c1c[n+](no1)CC=C | |
| AKOS005215735 | 167.165 | C7 H9 N3 O2 | CHKMCSVSJJWHKF-UHFFFAOYSA-N | InChI=1S/C7H9N3O2/c1-5(11)8-7-4-10(9-12-7)6-2-3-6/h4,6H,2-3H2,1H3 | CC(=O)[N-]c1c[n+](no1)C2CC2 | |
| AKOS005219500 | 199.23 | C7 H9 N3 O2 S | IQQBUQOOHBDHNJ-UHFFFAOYSA-N | InChI=1S/C7H9N3O2S/c1-4(2)10-7-6(12-9-10)8-5(11)3-13-7/h4H,3H2,1-2H3 | CC(C)[n+]1c2c(on1)[N-]C(=O)CS2 | |
| AKOS005214861 | 183.165 | C7 H9 N3 O3 | HGQAJUVRRMKXLC-UHFFFAOYSA-N | InChI=1S/C7H9N3O3/c1-4(11)6-7(8-5(2)12)13-9-10(6)3/h1-3H3 | CC(=O)c1c(on[n+]1C)[N-]C(=O)C | |
| AKOS005215639 | 183.165 | C7 H9 N3 O3 | VZELUEUNBAYLCL-UHFFFAOYSA-N | InChI=1S/C7H9N3O3/c1-3-10-6(4-11)7(13-9-10)8-5(2)12/h4H,3H2,1-2H3 | CC[n+]1c(c(on1)[N-]C(=O)C)C=O | |
| AKOS005215531 | 199.164 | C7 H9 N3 O4 | CZYKVVLPFJTPMZ-UHFFFAOYSA-N | InChI=1S/C7H9N3O4/c1-3-13-7(12)6(11)8-5-4-10(2)9-14-5/h4H,3H2,1-2H3 | CCOC(=O)C(=O)[N-]c1c[n+](no1)C | |
| AKOS005219731 | 231.229 | C7 H9 N3 O4 S | TYNDFUORTGJPSQ-UHFFFAOYSA-N | InChI=1S/C7H9N3O4S/c1-10-4(7(13)14-9-10)5-8-2-3(15-5)6(11)12/h3,5,8H,2H2,1H3,(H-,9,11,12,13) | C[n+]1c(c(on1)[O-])C2NCC(S2)C(=O)O | |
| AKOS005214964 | 215.637 | C8 H10 Cl N3 O2 | FWFDHXJAUOWTKM-UHFFFAOYSA-N | InChI=1S/C8H10ClN3O2/c1-5(13)10-8-7(4-9)12(11-14-8)6-2-3-6/h6H,2-4H2,1H3 | CC(=O)[N-]c1c([n+](no1)C2CC2)CCl | |
| AKOS005215018 | 215.637 | C8 H10 Cl N3 O2 | XPAPGOKBSUVKTL-UHFFFAOYSA-N | InChI=1S/C8H10ClN3O2/c1-3-4-12-7(5-9)8(14-11-12)10-6(2)13/h3H,1,4-5H2,2H3 | CC(=O)[N-]c1c([n+](no1)CC=C)CCl | |
| AKOS005219466 | 253.178 | C8 H10 F3 N3 O3 | HVVLGUUWXNULDT-UHFFFAOYSA-N | InChI=1S/C8H10F3N3O3/c1-4(2)14-5(3-15)6(17-13-14)12-7(16)8(9,10)11/h4,15H,3H2,1-2H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)C(F)(F)F)CO | |
| AKOS005252610 | 258.321 | C8 H10 N4 O2 S2 | FEQRPMPDSKBBQB-UHFFFAOYSA-N | InChI=1S/C8H10N4O2S2/c1-12-4-7(14-11-12)10-6(13)5-16-8-9-2-3-15-8/h4H,2-3,5H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSC2=NCCS2 | |
| AKOS005252453 | 286.334 | C8 H10 N6 O2 S2 | MAWIYPHVJVVVHE-UHFFFAOYSA-N | InChI=1S/C8H10N6O2S2/c1-2-14-3-6(16-13-14)10-5(15)4-17-8-12-11-7(9)18-8/h3H,2,4H2,1H3,(H2-,9,10,11,13,15) | CC[n+]1cc(on1)[N-]C(=O)CSc2nnc(s2)N | |
| AKOS005215655 | 246.651 | C8 H11 Cl N4 O3 | PDFIZYITTBYBEW-UHFFFAOYSA-N | InChI=1S/C8H11ClN4O3/c9-5-7(14)10-8-6-13(11-16-8)12-1-3-15-4-2-12/h6H,1-5H2 | c1c(on[n+]1N2CCOCC2)[N-]C(=O)CCl | |
| AKOS005219501 | 213.257 | C8 H11 N3 O2 S | VBAZGPSPXSTCPN-UHFFFAOYSA-N | InChI=1S/C8H11N3O2S/c1-4(2)11-8-7(13-10-11)9-6(12)5(3)14-8/h4-5H,1-3H3 | CC1C(=O)[N-]c2c([n+](no2)C(C)C)S1 | |
| AKOS005214860 | 197.191 | C8 H11 N3 O3 | ASEANYZDTYOQGX-UHFFFAOYSA-N | InChI=1S/C8H11N3O3/c1-4-11-7(5(2)12)8(14-10-11)9-6(3)13/h4H2,1-3H3 | CC[n+]1c(c(on1)[N-]C(=O)C)C(=O)C | |
| AKOS005214911 | 197.191 | C8 H11 N3 O3 | GMQSOYGZTVMTJO-UHFFFAOYSA-N | InChI=1S/C8H11N3O3/c1-5(13)9-8-7(4-12)11(10-14-8)6-2-3-6/h6,12H,2-4H2,1H3 | CC(=O)[N-]c1c([n+](no1)C2CC2)CO | |
| AKOS005215627 | 197.191 | C8 H11 N3 O3 | TUAVTIBTDXXSAT-UHFFFAOYSA-N | InChI=1S/C8H11N3O3/c1-3-4-11-7(5-12)8(14-10-11)9-6(2)13/h3,12H,1,4-5H2,2H3 | CC(=O)[N-]c1c([n+](no1)CC=C)CO | |
| AKOS005215638 | 197.191 | C8 H11 N3 O3 | PKRLKLQIUSVMGT-UHFFFAOYSA-N | InChI=1S/C8H11N3O3/c1-5(2)11-7(4-12)8(14-10-11)9-6(3)13/h4-5H,1-3H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)C)C=O | |
| AKOS005252685 | 301.349 | C8 H11 N7 O2 S2 | NZCPSZRZKMETTL-UHFFFAOYSA-N | InChI=1S/C8H11N7O2S2/c1-14(2)15-3-6(17-13-15)10-5(16)4-18-8-12-11-7(9)19-8/h3H,4H2,1-2H3,(H2-,9,10,11,13,16) | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2nnc(s2)N | |
| AKOS005214948 | 217.653 | C8 H12 Cl N3 O2 | VYOPGKQANNXYGF-UHFFFAOYSA-N | InChI=1S/C8H12ClN3O2/c1-5(2)12-7(4-9)8(14-11-12)10-6(3)13/h5H,4H2,1-3H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)C)CCl | |
| AKOS005214880 | 196.206 | C8 H12 N4 O2 | AYIQFMYMUPMEJG-UHFFFAOYSA-N | InChI=1S/C8H12N4O2/c1-3-4-12-7(5-9)8(14-11-12)10-6(2)13/h3H,1,4-5,9H2,2H3 | CC(=O)[N-]c1c([n+](no1)CC=C)CN | |
| AKOS005215050 | 196.206 | C8 H12 N4 O2 | MLPBSZBUGLTYEF-UHFFFAOYSA-N | InChI=1S/C8H12N4O2/c1-5(13)10-8-7(4-9)12(11-14-8)6-2-3-6/h6H,2-4,9H2,1H3 | CC(=O)[N-]c1c([n+](no1)C2CC2)CN | |
| AKOS005214876 | 212.206 | C8 H12 N4 O3 | WNKCFLZLCYVZIM-UHFFFAOYSA-N | InChI=1S/C8H12N4O3/c1-5(13)7-8(9-6(2)14)15-10-12(7)11(3)4/h1-4H3 | CC(=O)c1c(on[n+]1N(C)C)[N-]C(=O)C | |
| AKOS005215721 | 212.206 | C8 H12 N4 O3 | HGUVDAMTYUZWAJ-UHFFFAOYSA-N | InChI=1S/C8H12N4O3/c1-7(13)9-8-6-12(10-15-8)11-2-4-14-5-3-11/h6H,2-5H2,1H3 | CC(=O)[N-]c1c[n+](no1)N2CCOCC2 | |
| AKOS003279216 | 202.661 | C8 H13 N3 O . Cl | JZJULDSURBYYBG-UHFFFAOYSA-M | InChI=1S/C8H13N3O.ClH/c9-8-6-11(10-12-8)7-4-2-1-3-5-7;/h6-7,9H,1-5H2;1H/p-1 | c1c(on[n+]1C2CCCCC2)[NH-].[Cl-] | |
| AKOS000491267 | 203.669 | C8 H13 N3 O . Cl H | JZJULDSURBYYBG-UHFFFAOYSA-N | InChI=1S/C8H13N3O.ClH/c9-8-6-11(10-12-8)7-4-2-1-3-5-7;/h6-7,9H,1-5H2;1H | c1c(on[n+]1C2CCCCC2)[NH-].Cl | MFCD03130858 |
| AKOS005215741 | 183.208 | C8 H13 N3 O2 | AWVYWZXCOLEGLQ-UHFFFAOYSA-N | InChI=1S/C8H13N3O2/c1-3-4-5-11-6-8(13-10-11)9-7(2)12/h6H,3-5H2,1-2H3 | CCCC[n+]1cc(on1)[N-]C(=O)C | MFCD09881638 |
| AKOS005215535 | 215.273 | C8 H13 N3 O2 S | CNYCKWUQNCVYGG-UHFFFAOYSA-N | InChI=1S/C8H13N3O2S/c1-5(2)11-8(14-4)7(13-10-11)9-6(3)12/h5H,1-4H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)C)SC | |
| AKOS005214893 | 199.207 | C8 H13 N3 O3 | OEYMNZOQOFIWDX-UHFFFAOYSA-N | InChI=1S/C8H13N3O3/c1-5(2)11-7(4-12)8(14-10-11)9-6(3)13/h5,12H,4H2,1-3H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)C)CO | |
| AKOS005215000 | 199.207 | C8 H13 N3 O3 | UPIXGXCSAVMFGW-UHFFFAOYSA-N | InChI=1S/C8H13N3O3/c1-4-11-7(5(2)12)8(14-10-11)9-6(3)13/h5,12H,4H2,1-3H3 | CC[n+]1c(c(on1)[N-]C(=O)C)C(C)O | |
| AKOS005215577 | 199.207 | C8 H13 N3 O3 | WIRABXQHMMDNNC-UHFFFAOYSA-N | InChI=1S/C8H13N3O3/c1-8(2,3)13-7(12)9-6-5-11(4)10-14-6/h5H,1-4H3 | CC(C)(C)OC(=O)[N-]c1c[n+](no1)C | |
| AKOS005215697 | 215.207 | C8 H13 N3 O4 | HYSKEMJUTXCQBA-UHFFFAOYSA-N | InChI=1S/C8H13N3O4/c1-11-6(8(13)15-10-11)5-9-4-3-7(12)14-2/h9H,3-5H2,1-2H3 | C[n+]1c(c(on1)[O-])CNCCC(=O)OC | |
| AKOS005219485 | 215.207 | C8 H13 N3 O4 | LDTFRWFIWRRVFH-UHFFFAOYSA-N | InChI=1S/C8H13N3O4/c1-8(2,3)13-7(12)15-9-6-5-11(4)10-14-6/h5H,1-4H3 | CC(C)(C)OC(=O)O[N-]c1c[n+](no1)C | |
| AKOS001688956 | 168.216 | C8 H14 N3 O | GJGCXZHHOOIOLV-UHFFFAOYSA-N | InChI=1S/C8H14N3O/c9-8-6-11(10-12-8)7-4-2-1-3-5-7/h6-7H,1-5,9H2/q+1 | c1c(on[n+]1C2CCCCC2)N | |
| AKOS005215734 | 203.669 | C8 H14 N3 O . Cl | CUGZWHFAENTGQN-UHFFFAOYSA-M | InChI=1S/C8H14N3O.ClH/c9-8-6-11(10-12-8)7-4-2-1-3-5-7;/h6-7H,1-5,9H2;1H/q+1;/p-1 | c1c(on[n+]1C2CCCCC2)N.[Cl-] | |
| AKOS005214919 | 198.222 | C8 H14 N4 O2 | YJMFSASRZWATFF-UHFFFAOYSA-N | InChI=1S/C8H14N4O2/c1-4-12-7(5-9-3)8(14-11-12)10-6(2)13/h9H,4-5H2,1-3H3 | CC[n+]1c(c(on1)[N-]C(=O)C)CNC | |
| AKOS005215031 | 198.222 | C8 H14 N4 O2 | LNASRLRXGYKONA-UHFFFAOYSA-N | InChI=1S/C8H14N4O2/c1-5(2)12-7(4-9)8(14-11-12)10-6(3)13/h5H,4,9H2,1-3H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)C)CN | |
| AKOS005250101 | 230.287 | C8 H14 N4 O2 S | VWCIDQVUSQBHHU-UHFFFAOYSA-N | InChI=1S/C8H14N4O2S/c1-4-9-8(15)11(2)5-6-7(13)14-10-12(6)3/h4-5H2,1-3H3,(H-,9,10,13,15) | CCNC(=S)N(C)Cc1c(on[n+]1C)[O-] | |
| AKOS005214153 | 214.222 | C8 H14 N4 O3 | LQTOLYCFTJTUDP-UHFFFAOYSA-N | InChI=1S/C8H14N4O3/c1-11-7(8(13)15-10-11)6-9-12-2-4-14-5-3-12/h9H,2-6H2,1H3 | C[n+]1c(c(on1)[O-])CNN2CCOCC2 | |
| AKOS005215014 | 214.222 | C8 H14 N4 O3 | YZBKBAWTPTVTKA-UHFFFAOYSA-N | InChI=1S/C8H14N4O3/c1-5(13)7-8(9-6(2)14)15-10-12(7)11(3)4/h5,13H,1-4H3 | CC(c1c(on[n+]1N(C)C)[N-]C(=O)C)O | |
| AKOS005219890 | 246.287 | C8 H14 N4 O3 S | QMCDHGFQOSXAGC-UHFFFAOYSA-N | InChI=1S/C8H14N4O3S/c1-9-8(16)12(3-4-13)5-6-7(14)15-10-11(6)2/h13H,3-5H2,1-2H3,(H-,9,10,14,16) | CNC(=S)N(CCO)Cc1c(on[n+]1C)[O-] | |
| AKOS005214289 | 185.224 | C8 H15 N3 O2 | LJENWCHRQWILLX-UHFFFAOYSA-N | InChI=1S/C8H15N3O2/c1-4-6(2)9-5-7-8(12)13-10-11(7)3/h6,9H,4-5H2,1-3H3 | CCC(C)NCc1c(on[n+]1C)[O-] | |
| AKOS005214298 | 185.224 | C8 H15 N3 O2 | OKHYTVFVKRBJER-UHFFFAOYSA-N | InChI=1S/C8H15N3O2/c1-8(2,3)9-5-6-7(12)13-10-11(6)4/h9H,5H2,1-4H3 | CC(C)(C)NCc1c(on[n+]1C)[O-] | |
| AKOS005214167 | 201.223 | C8 H15 N3 O3 | YCDQKYRUURJRKR-UHFFFAOYSA-N | InChI=1S/C8H15N3O3/c1-11-7(8(12)14-10-11)6-9-4-3-5-13-2/h9H,3-6H2,1-2H3 | C[n+]1c(c(on1)[O-])CNCCCOC | |
| AKOS005214316 | 201.223 | C8 H15 N3 O3 | TUAMFKARIMLSIX-UHFFFAOYSA-N | InChI=1S/C8H15N3O3/c1-6(2)11-7(5-9-3-4-12)8(13)14-10-11/h6,9,12H,3-5H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNCCO | |
| AKOS005214313 | 217.222 | C8 H15 N3 O4 | QAFFQZPXYGLYCB-UHFFFAOYSA-N | InChI=1S/C8H15N3O4/c1-11-6(8(12)15-10-11)4-9-5-7(13-2)14-3/h7,9H,4-5H2,1-3H3 | C[n+]1c(c(on1)[O-])CNCC(OC)OC | |
| AKOS005215564 | 234.683 | C8 H15 N4 O2 . Cl | WUSGTJVJDRIXAM-UHFFFAOYSA-M | InChI=1S/C8H15N4O2.ClH/c9-8-7-12(10-14-8)2-1-11-3-5-13-6-4-11;/h7H,1-6,9H2;1H/q+1;/p-1 | c1c(on[n+]1CCN2CCOCC2)N.[Cl-] | |
| AKOS005214933 | 213.237 | C8 H15 N5 O2 | PFXUIJPMPAVPBJ-UHFFFAOYSA-N | InChI=1S/C8H15N5O2/c1-6(14)10-8-7(5-9-2)13(11-15-8)12(3)4/h9H,5H2,1-4H3 | CC(=O)[N-]c1c([n+](no1)N(C)C)CNC | |
| AKOS005214155 | 200.238 | C8 H16 N4 O2 | KLGHKQXYHHPCBP-UHFFFAOYSA-N | InChI=1S/C8H16N4O2/c1-11(2)5-4-9-6-7-8(13)14-10-12(7)3/h9H,4-6H2,1-3H3 | C[n+]1c(c(on1)[O-])CNCCN(C)C | |
| AKOS005215662 | 241.042 | C8 H5 Br N2 O2 | KIZKTBQGLPVCRL-UHFFFAOYSA-N | InChI=1S/C8H5BrN2O2/c9-7-8(12)13-10-11(7)6-4-2-1-3-5-6/h1-5H | c1ccc(cc1)[n+]2c(c(on2)[O-])Br | MFCD09881659 |
| AKOS000126834 | 260.654 | C8 H5 Cl N2 O4 S | IZHNRJDFIRXHFC-UHFFFAOYSA-N | InChI=1S/C8H5ClN2O4S/c9-16(13,14)7-8(12)15-10-11(7)6-4-2-1-3-5-6/h1-5H | c1ccc(cc1)[n+]2c(c(on2)[O-])S(=O)(=O)Cl | MFCD09042614 |
| AKOS003578179 | 162.145 | C8 H6 N2 O2 | KQEVEDHJIGSXDK-UHFFFAOYSA-N | InChI=1S/C8H6N2O2/c11-8-6-10(9-12-8)7-4-2-1-3-5-7/h1-6H | c1ccc(cc1)[n+]2cc(on2)[O-] | MFCD00205029 |
| AKOS005215634 | 194.21 | C8 H6 N2 O2 S | SQCMAFWJSGPUJR-UHFFFAOYSA-O | InChI=1S/C8H5N2O2S/c11-8-7(13)10(9-12-8)6-4-2-1-3-5-6/h1-5H/q-1/p+1 | c1ccc(cc1)[n+]2c(c(on2)[O-])S | MFCD09881662 |
| AKOS005219760 | 254.223 | C8 H6 N4 O4 S | FZUKZIRAQDVFNT-UHFFFAOYSA-N | InChI=1S/C8H6N4O4S/c1-12-4(7(15)16-11-12)2-3-5(13)9-8(17)10-6(3)14/h2H,1H3,(H2-,9,10,11,13,14,15,17) | C[n+]1c(c(on1)[O-])/C=C\2/C(=O)NC(=NC2=O)S | |
| AKOS005219739 | 209.159 | C8 H7 N3 O4 | ZMUUWQAGSRSPHM-UHFFFAOYSA-N | InChI=1S/C8H7N3O4/c1-4-5(7(12)14-9-4)3-6-8(13)15-10-11(6)2/h3H,1-2H3 | CC\1=NOC(=O)/C1=C/c2c(on[n+]2C)[O-] | |
| AKOS005219545 | 272.304 | C8 H8 N4 O3 S2 | RIMMMXBKCDYJNR-UHFFFAOYSA-N | InChI=1S/C8H8N4O3S2/c1-4-9-10-8(17-4)16-3-5(13)6-7(14)15-11-12(6)2/h3H2,1-2H3 | Cc1nnc(s1)SCC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005250680 | 268.253 | C8 H8 N6 O3 S | GKJGDVSROBXULM-UHFFFAOYSA-N | InChI=1S/C8H8N6O3S/c1-14-5(6(16)17-13-14)4(15)2-18-8-11-3-10-7(9)12-8/h3H,2H2,1H3,(H2-,9,10,11,12,13,15,16) | C[n+]1c(c(on1)[O-])C(=O)CSc2ncnc(n2)N | |
| AKOS005215653 | 195.175 | C8 H9 N3 O3 | WZPYHLLIIFFSRV-UHFFFAOYSA-N | InChI=1S/C8H9N3O3/c1-5(13)9-8-7(4-12)11(10-14-8)6-2-3-6/h4,6H,2-3H2,1H3 | CC(=O)[N-]c1c([n+](no1)C2CC2)C=O | |
| AKOS005215706 | 195.175 | C8 H9 N3 O3 | NXBIHQGKMFWIMO-UHFFFAOYSA-N | InChI=1S/C8H9N3O3/c1-3-4-11-7(5-12)8(14-10-11)9-6(2)13/h3,5H,1,4H2,2H3 | CC(=O)[N-]c1c([n+](no1)CC=C)C=O | |
| AKOS005219544 | 259.305 | C8 H9 N3 O3 S2 | XBLXTFHZCBMTJY-UHFFFAOYSA-N | InChI=1S/C8H9N3O3S2/c1-11-6(7(13)14-10-11)5(12)4-16-8-9-2-3-15-8/h2-4H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSC2=NCCS2 | |
| AKOS005252611 | 271.319 | C8 H9 N5 O2 S2 | IPQQJZJCAJQPSH-UHFFFAOYSA-N | InChI=1S/C8H9N5O2S2/c1-5-10-11-8(17-5)16-4-6(14)9-7-3-13(2)12-15-7/h3H,4H2,1-2H3 | Cc1nnc(s1)SCC(=O)[N-]c2c[n+](no2)C | |
| AKOS005252590 | 267.268 | C8 H9 N7 O2 S | QUZDLFLNRHJIJG-UHFFFAOYSA-N | InChI=1S/C8H9N7O2S/c1-15-2-6(17-14-15)12-5(16)3-18-8-11-4-10-7(9)13-8/h2,4H,3H2,1H3,(H2-,9,10,11,12,13,14,16) | C[n+]1cc(on1)[N-]C(=O)CSc2ncnc(n2)N | |
| AKOS005215537 | 211.648 | C9 H10 N3 O . Cl | TVTKPYSQWDCAJR-UHFFFAOYSA-M | InChI=1S/C9H10N3O.ClH/c10-9-7-12(11-13-9)6-8-4-2-1-3-5-8;/h1-5,7H,6,10H2;1H/q+1;/p-1 | c1ccc(cc1)C[n+]2cc(on2)N.[Cl-] | MFCD09881679 |
| AKOS005215545 | 211.648 | C9 H10 N3 O . Cl | DTAZPBMEFBNKRI-UHFFFAOYSA-M | InChI=1S/C9H10N3O.ClH/c1-12-8(9(10)13-11-12)7-5-3-2-4-6-7;/h2-6H,10H2,1H3;1H/q+1;/p-1 | C[n+]1c(c(on1)N)c2ccccc2.[Cl-] | |
| AKOS005219546 | 254.266 | C9 H10 N4 O3 S | SCILWSNRLUZWPG-UHFFFAOYSA-N | InChI=1S/C9H10N4O3S/c1-12-4-3-10-9(12)17-5-6(14)7-8(15)16-11-13(7)2/h3-4H,5H2,1-2H3 | Cn1ccnc1SCC(=O)c2c(on[n+]2C)[O-] | |
| AKOS005250683 | 282.279 | C9 H10 N6 O3 S | QRNOFRKXZHDZIF-UHFFFAOYSA-N | InChI=1S/C9H10N6O3S/c1-15-7(8(17)18-14-15)4(16)3-19-9-12-5(10)2-6(11)13-9/h2H,3H2,1H3,(H4-,10,11,12,13,14,16,17) | C[n+]1c(c(on1)[O-])C(=O)CSc2nc(cc(n2)N)N | |
| AKOS005214286 | 225.268 | C9 H11 N3 O2 S | MHWKNDVXLPPIJU-UHFFFAOYSA-N | InChI=1S/C9H11N3O2S/c1-12-8(9(13)14-11-12)6-10-5-7-3-2-4-15-7/h2-4,10H,5-6H2,1H3 | C[n+]1c(c(on1)[O-])CNCc2cccs2 | |
| AKOS005214264 | 209.202 | C9 H11 N3 O3 | UYJBTLHCDDFIEK-UHFFFAOYSA-N | InChI=1S/C9H11N3O3/c1-12-8(9(13)15-11-12)6-10-5-7-3-2-4-14-7/h2-4,10H,5-6H2,1H3 | C[n+]1c(c(on1)[O-])CNCc2ccco2 | |
| AKOS005214877 | 209.202 | C9 H11 N3 O3 | DRGWHCNNTTWGND-UHFFFAOYSA-N | InChI=1S/C9H11N3O3/c1-5(13)8-9(10-6(2)14)15-11-12(8)7-3-4-7/h7H,3-4H2,1-2H3 | CC(=O)c1c(on[n+]1C2CC2)[N-]C(=O)C | |
| AKOS005214937 | 209.202 | C9 H11 N3 O3 | QWEADLRONLJTJE-UHFFFAOYSA-N | InChI=1S/C9H11N3O3/c1-4-5-12-8(6(2)13)9(15-11-12)10-7(3)14/h4H,1,5H2,2-3H3 | CC(=O)c1c(on[n+]1CC=C)[N-]C(=O)C | |
| AKOS005252612 | 253.281 | C9 H11 N5 O2 S | SBTUQWPYZWWTJG-UHFFFAOYSA-N | InChI=1S/C9H11N5O2S/c1-13-4-3-10-9(13)17-6-7(15)11-8-5-14(2)12-16-8/h3-5H,6H2,1-2H3 | Cn1ccnc1SCC(=O)[N-]c2c[n+](no2)C | |
| AKOS005252498 | 285.346 | C9 H11 N5 O2 S2 | NQHSKARWDVTABG-UHFFFAOYSA-N | InChI=1S/C9H11N5O2S2/c1-3-14-4-8(16-13-14)10-7(15)5-17-9-12-11-6(2)18-9/h4H,3,5H2,1-2H3 | CC[n+]1cc(on1)[N-]C(=O)CSc2nnc(s2)C | |
| AKOS005252487 | 281.294 | C9 H11 N7 O2 S | DYEPMTXDZNSCSO-UHFFFAOYSA-N | InChI=1S/C9H11N7O2S/c1-2-16-3-7(18-15-16)13-6(17)4-19-9-12-5-11-8(10)14-9/h3,5H,2,4H2,1H3,(H2-,10,11,12,13,14,15,17) | CC[n+]1cc(on1)[N-]C(=O)CSc2ncnc(n2)N | |
| AKOS005252575 | 281.294 | C9 H11 N7 O2 S | KPFBOJKTOBOVCK-UHFFFAOYSA-N | InChI=1S/C9H11N7O2S/c1-16-3-8(18-15-16)14-7(17)4-19-9-12-5(10)2-6(11)13-9/h2-3H,4H2,1H3,(H4-,10,11,12,13,14,15,17) | C[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)N)N | |
| AKOS005252497 | 272.347 | C9 H12 N4 O2 S2 | MVUKFAQOPVTSBT-UHFFFAOYSA-N | InChI=1S/C9H12N4O2S2/c1-2-13-5-8(15-12-13)11-7(14)6-17-9-10-3-4-16-9/h5H,2-4,6H2,1H3 | CC[n+]1cc(on1)[N-]C(=O)CSC2=NCCS2 | |
| AKOS005215687 | 224.217 | C9 H12 N4 O3 | GAGFGPXQBJOAOE-UHFFFAOYSA-N | InChI=1S/C9H12N4O3/c1-4-5-10-9(15)12(2)6-7-8(14)16-11-13(7)3/h1H,5-6H2,2-3H3,(H-,10,11,14,15) | C[n+]1c(c(on1)[O-])CN(C)C(=O)NCC#C | |
| AKOS005215650 | 240.216 | C9 H12 N4 O4 | GODFIXWIEUUYIE-UHFFFAOYSA-N | InChI=1S/C9H12N4O4/c1-7(15)10-9-8(6-14)13(11-17-9)12-2-4-16-5-3-12/h6H,2-5H2,1H3 | CC(=O)[N-]c1c([n+](no1)N2CCOCC2)C=O | |
| AKOS005252672 | 300.361 | C9 H12 N6 O2 S2 | XOMMOXBXFMXUCM-UHFFFAOYSA-N | InChI=1S/C9H12N6O2S2/c1-6-11-12-9(19-6)18-5-7(16)10-8-4-15(13-17-8)14(2)3/h4H,5H2,1-3H3 | Cc1nnc(s1)SCC(=O)[N-]c2c[n+](no2)N(C)C | |
| AKOS005252868 | 300.361 | C9 H12 N6 O2 S2 | HBZAEUDISKTCAW-UHFFFAOYSA-N | InChI=1S/C9H12N6O2S2/c1-5(2)15-3-7(17-14-15)11-6(16)4-18-9-13-12-8(10)19-9/h3,5H,4H2,1-2H3,(H2-,10,11,12,14,16) | CC(C)[n+]1cc(on1)[N-]C(=O)CSc2nnc(s2)N | |
| AKOS005253403 | 316.36 | C9 H12 N6 O3 S2 | JXIWXVTVJXTBBK-UHFFFAOYSA-N | InChI=1S/C9H12N6O3S2/c1-17-3-2-15-4-7(18-14-15)11-6(16)5-19-9-13-12-8(10)20-9/h4H,2-3,5H2,1H3,(H2-,10,11,12,14,16) | COCC[n+]1cc(on1)[N-]C(=O)CSc2nnc(s2)N | |
| AKOS005252780 | 296.309 | C9 H12 N8 O2 S | HMIDHVARQTVRGB-UHFFFAOYSA-N | InChI=1S/C9H12N8O2S/c1-16(2)17-3-7(19-15-17)13-6(18)4-20-9-12-5-11-8(10)14-9/h3,5H,4H2,1-2H3,(H2-,10,11,12,13,14,15,18) | CN(C)[n+]1cc(on1)[N-]C(=O)CSc2ncnc(n2)N | |
| AKOS005215656 | 244.678 | C9 H13 Cl N4 O2 | NCOJUFGSKFUVMJ-UHFFFAOYSA-N | InChI=1S/C9H13ClN4O2/c10-6-8(15)11-9-7-14(12-16-9)13-4-2-1-3-5-13/h7H,1-6H2 | c1c(on[n+]1N2CCCCC2)[N-]C(=O)CCl | |
| AKOS005214961 | 260.678 | C9 H13 Cl N4 O3 | BJEZAOTUMSBEQH-UHFFFAOYSA-N | InChI=1S/C9H13ClN4O3/c1-7(15)11-9-8(6-10)14(12-17-9)13-2-4-16-5-3-13/h2-6H2,1H3 | CC(=O)[N-]c1c([n+](no1)N2CCOCC2)CCl | |
| AKOS005214859 | 211.218 | C9 H13 N3 O3 | XKTGOSFCMUMICN-UHFFFAOYSA-N | InChI=1S/C9H13N3O3/c1-5(2)12-8(6(3)13)9(15-11-12)10-7(4)14/h5H,1-4H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)C)C(=O)C | |
| AKOS005215015 | 211.218 | C9 H13 N3 O3 | REHPLPUGQWPACU-UHFFFAOYSA-N | InChI=1S/C9H13N3O3/c1-5(13)8-9(10-6(2)14)15-11-12(8)7-3-4-7/h5,7,13H,3-4H2,1-2H3 | CC(c1c(on[n+]1C2CC2)[N-]C(=O)C)O | |
| AKOS005215076 | 211.218 | C9 H13 N3 O3 | MNMBHDYDXVBGJV-UHFFFAOYSA-N | InChI=1S/C9H13N3O3/c1-4-5-12-8(6(2)13)9(15-11-12)10-7(3)14/h4,6,13H,1,5H2,2-3H3 | CC(c1c(on[n+]1CC=C)[N-]C(=O)C)O | |
| AKOS005250362 | 211.218 | C9 H13 N3 O3 | UMWGYNRGRSLTCF-UHFFFAOYSA-N | InChI=1S/C9H13N3O3/c1-11(8(13)6-3-4-6)5-7-9(14)15-10-12(7)2/h6H,3-5H2,1-2H3 | C[n+]1c(c(on1)[O-])CN(C)C(=O)C2CC2 | |
| AKOS005215442 | 227.217 | C9 H13 N3 O4 | WBOFUQUXSCHUFK-UHFFFAOYSA-N | InChI=1S/C9H13N3O4/c1-4-15-9(14)8(13)10-7-5-12(6(2)3)11-16-7/h5-6H,4H2,1-3H3 | CCOC(=O)C(=O)[N-]c1c[n+](no1)C(C)C | |
| AKOS005252789 | 287.362 | C9 H13 N5 O2 S2 | RROGQZXQTGWGBW-UHFFFAOYSA-N | InChI=1S/C9H13N5O2S2/c1-13(2)14-5-8(16-12-14)11-7(15)6-18-9-10-3-4-17-9/h5H,3-4,6H2,1-2H3 | CN(C)[n+]1cc(on1)[N-]C(=O)CSC2=NCCS2 | |
| AKOS005215410 | 276.13 | C9 H14 Br N3 O2 | ZVKTWAUBWQHDLQ-UHFFFAOYSA-N | InChI=1S/C9H14BrN3O2/c1-3-4-5-13-6-8(15-12-13)11-9(14)7(2)10/h6-7H,3-5H2,1-2H3 | CCCC[n+]1cc(on1)[N-]C(=O)C(C)Br | |
| AKOS005214934 | 210.233 | C9 H14 N4 O2 | XVIZLUMQHOVIJQ-UHFFFAOYSA-N | InChI=1S/C9H14N4O2/c1-6(14)11-9-8(5-10-2)13(12-15-9)7-3-4-7/h7,10H,3-5H2,1-2H3 | CC(=O)[N-]c1c([n+](no1)C2CC2)CNC | |
| AKOS005214987 | 210.233 | C9 H14 N4 O2 | UFXUCZLMXDHCLH-UHFFFAOYSA-N | InChI=1S/C9H14N4O2/c1-4-5-13-8(6-10-3)9(15-12-13)11-7(2)14/h4,10H,1,5-6H2,2-3H3 | CC(=O)[N-]c1c([n+](no1)CC=C)CNC | |
| AKOS005215722 | 210.233 | C9 H14 N4 O2 | SCYFTCVHCNQEMR-UHFFFAOYSA-N | InChI=1S/C9H14N4O2/c1-8(14)10-9-7-13(11-15-9)12-5-3-2-4-6-12/h7H,2-6H2,1H3 | CC(=O)[N-]c1c[n+](no1)N2CCCCC2 | |
| AKOS005219805 | 242.298 | C9 H14 N4 O2 S | NHWYXHGEXHYFEL-UHFFFAOYSA-N | InChI=1S/C9H14N4O2S/c1-12(9(16)10-6-3-4-6)5-7-8(14)15-11-13(7)2/h6H,3-5H2,1-2H3,(H-,10,11,14,16) | C[n+]1c(c(on1)[O-])CN(C)C(=S)NC2CC2 | |
| AKOS005214908 | 242.232 | C9 H14 N4 O4 | YTGUZECPRMXXFL-UHFFFAOYSA-N | InChI=1S/C9H14N4O4/c1-7(15)10-9-8(6-14)13(11-17-9)12-2-4-16-5-3-12/h14H,2-6H2,1H3 | CC(=O)[N-]c1c([n+](no1)N2CCOCC2)CO | |
| AKOS005214168 | 197.234 | C9 H15 N3 O2 | RPOFYPJXGOJWAM-UHFFFAOYSA-N | InChI=1S/C9H15N3O2/c1-6(2)12-8(9(13)14-11-12)5-10-7-3-4-7/h6-7,10H,3-5H2,1-2H3 | CC(C)[n+]1c(c(on1)[O-])CNC2CC2 | |
| AKOS005214206 | 197.234 | C9 H15 N3 O2 | RZUYCOZCFKQYEB-UHFFFAOYSA-N | InChI=1S/C9H15N3O2/c1-4-5-10-6-8-9(13)14-11-12(8)7(2)3/h4,7,10H,1,5-6H2,2-3H3 | CC(C)[n+]1c(c(on1)[O-])CNCC=C | |
| AKOS005214238 | 197.234 | C9 H15 N3 O2 | NWUJUPLPVLPZBC-UHFFFAOYSA-N | InChI=1S/C9H15N3O2/c1-12-8(9(13)14-11-12)6-10-7-4-2-3-5-7/h7,10H,2-6H2,1H3 | C[n+]1c(c(on1)[O-])CNC2CCCC2 | |
| AKOS005214278 | 213.234 | C9 H15 N3 O3 | AWKRINDXKBADTL-UHFFFAOYSA-N | InChI=1S/C9H15N3O3/c1-12-8(9(13)15-11-12)6-10-5-7-3-2-4-14-7/h7,10H,2-6H2,1H3 | C[n+]1c(c(on1)[O-])CNCC2CCCO2 | |
| AKOS005214999 | 213.234 | C9 H15 N3 O3 | NHQDCGANBONKGW-UHFFFAOYSA-N | InChI=1S/C9H15N3O3/c1-5(2)12-8(6(3)13)9(15-11-12)10-7(4)14/h5-6,13H,1-4H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)C)C(C)O | |
| AKOS005215576 | 213.234 | C9 H15 N3 O3 | FBCHDSVHEZCNDY-UHFFFAOYSA-N | InChI=1S/C9H15N3O3/c1-5-12-6-7(15-11-12)10-8(13)14-9(2,3)4/h6H,5H2,1-4H3 | CC[n+]1cc(on1)[N-]C(=O)OC(C)(C)C | |
| AKOS005250372 | 213.234 | C9 H15 N3 O3 | QVEKOKZSEVQUAV-UHFFFAOYSA-N | InChI=1S/C9H15N3O3/c1-4-5-8(13)11(2)6-7-9(14)15-10-12(7)3/h4-6H2,1-3H3 | CCCC(=O)N(C)Cc1c(on[n+]1C)[O-] | |
| AKOS005219464 | 229.233 | C9 H15 N3 O4 | JBCAWQRYPGDVAE-UHFFFAOYSA-N | InChI=1S/C9H15N3O4/c1-5-12-6-7(15-11-12)10-16-8(13)14-9(2,3)4/h6H,5H2,1-4H3 | CC[n+]1cc(on1)[N-]OC(=O)OC(C)(C)C | |
| AKOS005215047 | 241.247 | C9 H15 N5 O3 | BFTYGRUVNLWOPC-UHFFFAOYSA-N | InChI=1S/C9H15N5O3/c1-7(15)11-9-8(6-10)14(12-17-9)13-2-4-16-5-3-13/h2-6,10H2,1H3 | CC(=O)[N-]c1c([n+](no1)N2CCOCC2)CN | |
| AKOS005215733 | 217.696 | C9 H16 N3 O . Cl | BMZHBLKWRYDHCO-UHFFFAOYSA-M | InChI=1S/C9H16N3O.ClH/c10-9-7-12(11-13-9)8-5-3-1-2-4-6-8;/h7-8H,1-6,10H2;1H/q+1;/p-1 | c1c(on[n+]1C2CCCCCC2)N.[Cl-] | |
| AKOS005214154 | 212.249 | C9 H16 N4 O2 | HOPCNHMEQGRXJH-UHFFFAOYSA-N | InChI=1S/C9H16N4O2/c1-12-8(9(14)15-11-12)7-10-13-5-3-2-4-6-13/h10H,2-7H2,1H3 | C[n+]1c(c(on1)[O-])CNN2CCCCC2 | |
| AKOS005214918 | 212.249 | C9 H16 N4 O2 | JQCNDINRTKAXNO-UHFFFAOYSA-N | InChI=1S/C9H16N4O2/c1-6(2)13-8(5-10-4)9(15-12-13)11-7(3)14/h6,10H,5H2,1-4H3 | CC(C)[n+]1c(c(on1)[N-]C(=O)C)CNC | |
| AKOS005215530 | 212.249 | C9 H16 N4 O2 | BQTFDQPHSBZDCZ-UHFFFAOYSA-N | InChI=1S/C9H16N4O2/c1-9(2,3)8(14)10-7-6-13(11-15-7)12(4)5/h6H,1-5H3 | CC(C)(C)C(=O)[N-]c1c[n+](no1)N(C)C | |
| AKOS005219499 | 212.249 | C9 H16 N4 O2 | ZANHNLYNVIWQLB-UHFFFAOYSA-N | InChI=1S/C9H16N4O2/c1-7(2)13-6-9(15-11-13)10-8(14)5-12(3)4/h6-7H,5H2,1-4H3 | CC(C)[n+]1cc(on1)[N-]C(=O)CN(C)C | |
| AKOS005215589 | 228.248 | C9 H16 N4 O3 | HGJQSNSQSWAWFZ-UHFFFAOYSA-N | InChI=1S/C9H16N4O3/c1-9(2,3)15-8(14)10-7-6-13(11-16-7)12(4)5/h6H,1-5H3 | CC(C)(C)OC(=O)[N-]c1c[n+](no1)N(C)C | |
| AKOS005214299 | 199.25 | C9 H17 N3 O2 | NBEYHPZGQWMGMY-UHFFFAOYSA-N | InChI=1S/C9H17N3O2/c1-5-9(2,3)10-6-7-8(13)14-11-12(7)4/h10H,5-6H2,1-4H3 | CCC(C)(C)NCc1c(on[n+]1C)[O-] | |
| AKOS005214262 | 215.25 | C9 H17 N3 O3 | LUDZIMCCNMMGRI-UHFFFAOYSA-N | InChI=1S/C9H17N3O3/c1-3-14-6-4-5-10-7-8-9(13)15-11-12(8)2/h10H,3-7H2,1-2H3 | CCOCCCNCc1c(on[n+]1C)[O-] | |
| AKOS005214165 | 214.265 | C9 H18 N4 O2 | LZWOQLSXZGHSAG-UHFFFAOYSA-N | InChI=1S/C9H18N4O2/c1-12(2)6-4-5-10-7-8-9(14)15-11-13(8)3/h10H,4-7H2,1-3H3 | C[n+]1c(c(on1)[O-])CNCCCN(C)C | |
| AKOS005214202 | 190.156 | C9 H6 N2 O3 | FAJWCIJHURGJSA-UHFFFAOYSA-N | InChI=1S/C9H6N2O3/c12-6-8-9(13)14-10-11(8)7-4-2-1-3-5-7/h1-6H | c1ccc(cc1)[n+]2c(c(on2)[O-])C=O | |
| AKOS005219848 | 206.155 | C9 H6 N2 O4 | TVKANJPJIUTJCI-UHFFFAOYSA-N | InChI=1S/C9H6N2O4/c12-8(13)7-9(14)15-10-11(7)6-4-2-1-3-5-6/h1-5H,(H-,10,12,13,14) | c1ccc(cc1)[n+]2c(c(on2)[O-])C(=O)O | |
| AKOS005215538 | 280.538 | C9 H8 Cl2 N3 O . Cl | BEQSZRHUHFUPCM-UHFFFAOYSA-M | InChI=1S/C9H8Cl2N3O.ClH/c10-7-2-1-6(8(11)3-7)4-14-5-9(12)15-13-14;/h1-3,5H,4,12H2;1H/q+1;/p-1 | c1cc(c(cc1Cl)Cl)C[n+]2cc(on2)N.[Cl-] | |
| AKOS003415457 | 176.172 | C9 H8 N2 O2 | VRJLMYJFAGRJGJ-UHFFFAOYSA-N | InChI=1S/C9H8N2O2/c1-11-8(9(12)13-10-11)7-5-3-2-4-6-7/h2-6H,1H3 | C[n+]1c(c(on1)[O-])c2ccccc2 | MFCD00597647 |
| AKOS003578180 | 176.172 | C9 H8 N2 O2 | PQBFRUJESKYJDP-UHFFFAOYSA-N | InChI=1S/C9H8N2O2/c1-7-9(12)13-10-11(7)8-5-3-2-4-6-8/h2-6H,1H3 | Cc1c(on[n+]1c2ccccc2)[O-] | MFCD01682762 |
| AKOS005215684 | 208.237 | C9 H8 N2 O2 S | SIFAMSQKJIWJQM-UHFFFAOYSA-N | InChI=1S/C9H8N2O2S/c1-14-8-9(12)13-10-11(8)7-5-3-2-4-6-7/h2-6H,1H3 | CSc1c(on[n+]1c2ccccc2)[O-] | MFCD09881663 |
| AKOS001041698 | 192.171 | C9 H8 N2 O3 | XKOKWEIDVXNUAS-UHFFFAOYSA-N | InChI=1S/C9H8N2O3/c1-13-8-5-3-2-4-7(8)11-6-9(12)14-10-11/h2-6H,1H3 | COc1ccccc1[n+]2cc(on2)[O-] | MFCD01325643 |
| AKOS001688175 | 192.171 | C9 H8 N2 O3 | MDXSZGJOBTZROY-UHFFFAOYSA-N | InChI=1S/C9H8N2O3/c1-13-8-4-2-7(3-5-8)11-6-9(12)14-10-11/h2-6H,1H3 | COc1ccc(cc1)[n+]2cc(on2)[O-] | MFCD01682761 |
| AKOS005215674 | 192.171 | C9 H8 N2 O3 | FUCYVCFTHDXUHP-UHFFFAOYSA-N | InChI=1S/C9H8N2O3/c12-6-8-9(13)14-10-11(8)7-4-2-1-3-5-7/h1-5,12H,6H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CO | |
| AKOS005219725 | 224.236 | C9 H8 N2 O3 S | YZKBMZVBXSZAMT-UHFFFAOYSA-O | InChI=1S/C9H7N2O3S/c1-13-7-4-2-6(3-5-7)11-8(15)9(12)14-10-11/h2-5H,1H3/q-1/p+1 | COc1ccc(cc1)[n+]2c(c(on2)[O-])S | |
| AKOS005219547 | 252.25 | C9 H8 N4 O3 S | DIFUGIKMFFTSJG-UHFFFAOYSA-N | InChI=1S/C9H8N4O3S/c1-13-7(8(15)16-12-13)6(14)5-17-9-10-3-2-4-11-9/h2-4H,5H2,1H3 | C[n+]1c(c(on1)[O-])C(=O)CSc2ncccn2 | |
| AKOS005250684 | 284.249 | C9 H8 N4 O5 S | GRWAVDNGPAOYMM-UHFFFAOYSA-N | InChI=1S/C9H8N4O5S/c1-13-7(8(17)18-12-13)4(14)3-19-9-10-5(15)2-6(16)11-9/h2H,3H2,1H3,(H2-,10,11,12,14,15,16,17) | C[n+]1c(c(on1)[O-])C(=O)CSc2nc(cc(n2)O)O | |
| AKOS005215552 | 246.093 | C9 H9 Cl N3 O . Cl | OYZLYEVGYNMFHH-UHFFFAOYSA-M | InChI=1S/C9H9ClN3O.ClH/c10-8-4-2-1-3-7(8)5-13-6-9(11)14-12-13;/h1-4,6H,5,11H2;1H/q+1;/p-1 | c1ccc(c(c1)C[n+]2cc(on2)N)Cl.[Cl-] | |
| AKOS005215539 | 229.639 | C9 H9 F N3 O . Cl | XXOIZLDLNFHPOL-UHFFFAOYSA-M | InChI=1S/C9H9FN3O.ClH/c10-8-3-1-7(2-4-8)5-13-6-9(11)14-12-13;/h1-4,6H,5,11H2;1H/q+1;/p-1 | c1cc(ccc1C[n+]2cc(on2)N)F.[Cl-] | |
| AKOS003415497 | 210.64 | C9 H9 N3 O . Cl | MTJJOBATZGAILP-UHFFFAOYSA-M | InChI=1S/C9H9N3O.ClH/c1-12-8(9(10)13-11-12)7-5-3-2-4-6-7;/h2-6,10H,1H3;1H/p-1 | C[n+]1c(c(on1)[NH-])c2ccccc2.[Cl-] | MFCD06614536 |
| AKOS003807333 | 211.648 | C9 H9 N3 O . Cl H | MTJJOBATZGAILP-UHFFFAOYSA-N | InChI=1S/C9H9N3O.ClH/c1-12-8(9(10)13-11-12)7-5-3-2-4-6-7;/h2-6,10H,1H3;1H | C[n+]1c(c(on1)[NH-])c2ccccc2.Cl | MFCD03130859 |
| AKOS005214218 | 191.187 | C9 H9 N3 O2 | LQAGGIYTKZQPPM-UHFFFAOYSA-N | InChI=1S/C9H9N3O2/c10-6-8-9(13)14-11-12(8)7-4-2-1-3-5-7/h1-5H,6,10H2 | c1ccc(cc1)[n+]2c(c(on2)[O-])CN | |
| AKOS005219754 | 223.185 | C9 H9 N3 O4 | BPMZMRINCCKGPE-UHFFFAOYSA-N | InChI=1S/C9H9N3O4/c1-3-15-8(13)6(5-10)4-7-9(14)16-11-12(7)2/h4H,3H2,1-2H3 | CCOC(=O)/C(=C/c1c(on[n+]1C)[O-])/C#N | |
| AKOS005252637 | 251.265 | C9 H9 N5 O2 S | XFOHESIGOPVDID-UHFFFAOYSA-N | InChI=1S/C9H9N5O2S/c1-14-5-8(16-13-14)12-7(15)6-17-9-10-3-2-4-11-9/h2-5H,6H2,1H3 | C[n+]1cc(on1)[N-]C(=O)CSc2ncccn2 | |
| AKOS005252576 | 283.264 | C9 H9 N5 O4 S | FHSMWLWZBXCICC-UHFFFAOYSA-N | InChI=1S/C9H9N5O4S/c1-14-3-8(18-13-14)10-7(17)4-19-9-11-5(15)2-6(16)12-9/h2-3H,4H2,1H3,(H2-,10,11,12,13,15,16,17) | C[n+]1cc(on1)[N-]C(=O)CSc2nc(cc(n2)O)O |
|
|