inchi stringlengths 33 163 | smiles stringlengths 15 57 |
|---|---|
InChI=1S/C20H21N5O/c1-14(26)25-10-7-16-11-18(3-4-19(16)25)22-12-17-13-24(2)23-20(17)15-5-8-21-9-6-15/h3-6,8-9,11,13,22H,7,10,12H2,1-2H3 | CC(=O)N1CCc2cc(NCc3cn(C)nc3-c3ccncc3)ccc21 |
InChI=1S/C18H24N4O2/c1-12-17(13(2)22(20-12)8-9-23)11-19-16-4-5-18-15(10-16)6-7-21(18)14(3)24/h4-5,10,19,23H,6-9,11H2,1-3H3 | CC(=O)N1CCc2cc(NCc3c(C)nn(CCO)c3C)ccc21 |
InChI=1S/C18H23N3OS/c1-12(22)21-8-7-13-9-14(5-6-16(13)21)19-10-15-11-23-17(20-15)18(2,3)4/h5-6,9,11,19H,7-8,10H2,1-4H3 | CC(=O)N1CCc2cc(NCc3csc(C(C)(C)C)n3)ccc21 |
InChI=1S/C20H24N2O2/c1-14-10-16(11-15(2)20(14)24-3)13-21-17-6-4-7-18(12-17)22-9-5-8-19(22)23/h4,6-7,10-12,21H,5,8-9,13H2,1-3H3 | COc1c(C)cc(CNc2cccc(N3CCCC3=O)c2)cc1C |
InChI=1S/C16H19N3OS/c1-2-15-18-13(11-21-15)10-17-12-5-3-6-14(9-12)19-8-4-7-16(19)20/h3,5-6,9,11,17H,2,4,7-8,10H2,1H3 | CCc1nc(CNc2cccc(N3CCCC3=O)c2)cs1 |
InChI=1S/C20H21N5O/c1-24-14-16(20(23-24)15-5-3-9-21-12-15)13-22-17-6-2-7-18(11-17)25-10-4-8-19(25)26/h2-3,5-7,9,11-12,14,22H,4,8,10,13H2,1H3 | Cn1cc(CNc2cccc(N3CCCC3=O)c2)c(-c2cccnc2)n1 |
InChI=1S/C20H21N5O/c1-24-14-16(20(23-24)15-7-9-21-10-8-15)13-22-17-4-2-5-18(12-17)25-11-3-6-19(25)26/h2,4-5,7-10,12,14,22H,3,6,11,13H2,1H3 | Cn1cc(CNc2cccc(N3CCCC3=O)c2)c(-c2ccncc2)n1 |
InChI=1S/C18H23N3OS/c1-18(2,3)17-20-14(12-23-17)11-19-13-6-4-7-15(10-13)21-9-5-8-16(21)22/h4,6-7,10,12,19H,5,8-9,11H2,1-3H3 | CC(C)(C)c1nc(CNc2cccc(N3CCCC3=O)c2)cs1 |
InChI=1S/C18H20N2O2S/c1-11-6-13(7-12(2)18(11)22-3)9-19-14-4-5-16-15(8-14)20-17(21)10-23-16/h4-8,19H,9-10H2,1-3H3,(H,20,21) | COc1c(C)cc(CNc2ccc3c(c2)NC(=O)CS3)cc1C |
InChI=1S/C14H15N3OS2/c1-2-14-16-10(7-20-14)6-15-9-3-4-12-11(5-9)17-13(18)8-19-12/h3-5,7,15H,2,6,8H2,1H3,(H,17,18) | CCc1nc(CNc2ccc3c(c2)NC(=O)CS3)cs1 |
InChI=1S/C16H20N4O2S/c1-10-13(11(2)20(19-10)5-6-21)8-17-12-3-4-15-14(7-12)18-16(22)9-23-15/h3-4,7,17,21H,5-6,8-9H2,1-2H3,(H,18,22) | Cc1nn(CCO)c(C)c1CNc1ccc2c(c1)NC(=O)CS2 |
InChI=1S/C16H19N3OS2/c1-16(2,3)15-18-11(8-22-15)7-17-10-4-5-13-12(6-10)19-14(20)9-21-13/h4-6,8,17H,7,9H2,1-3H3,(H,19,20) | CC(C)(C)c1nc(CNc2ccc3c(c2)NC(=O)CS3)cs1 |
InChI=1S/C17H20N2O2S/c1-18-17(20)12-21-16-6-4-3-5-13(16)11-19-14-7-9-15(22-2)10-8-14/h3-10,19H,11-12H2,1-2H3,(H,18,20) | CNC(=O)COc1ccccc1CNc1ccc(SC)cc1 |
InChI=1S/C17H18N4S/c1-21-12-14(17(20-21)13-4-3-9-18-10-13)11-19-15-5-7-16(22-2)8-6-15/h3-10,12,19H,11H2,1-2H3 | CSc1ccc(NCc2cn(C)nc2-c2cccnc2)cc1 |
InChI=1S/C17H18N4S/c1-21-12-14(17(20-21)13-7-9-18-10-8-13)11-19-15-3-5-16(22-2)6-4-15/h3-10,12,19H,11H2,1-2H3 | CSc1ccc(NCc2cn(C)nc2-c2ccncc2)cc1 |
InChI=1S/C18H22N2O2S/c1-20(2)18(21)13-22-17-7-5-4-6-14(17)12-19-15-8-10-16(23-3)11-9-15/h4-11,19H,12-13H2,1-3H3 | CSc1ccc(NCc2ccccc2OCC(=O)N(C)C)cc1 |
InChI=1S/C17H21N3O2S/c1-3-16-19-13(11-23-16)10-18-12-6-7-14(15(9-12)22-2)20-8-4-5-17(20)21/h6-7,9,11,18H,3-5,8,10H2,1-2H3 | CCc1nc(CNc2ccc(N3CCCC3=O)c(OC)c2)cs1 |
InChI=1S/C16H19N3OS/c1-2-15-18-14(10-21-15)9-17-12-5-7-13(8-6-12)19-16(20)11-3-4-11/h5-8,10-11,17H,2-4,9H2,1H3,(H,19,20) | CCc1nc(CNc2ccc(NC(=O)C3CC3)cc2)cs1 |
InChI=1S/C20H21N5O/c1-25-13-16(19(24-25)15-3-2-10-21-11-15)12-22-17-6-8-18(9-7-17)23-20(26)14-4-5-14/h2-3,6-11,13-14,22H,4-5,12H2,1H3,(H,23,26) | Cn1cc(CNc2ccc(NC(=O)C3CC3)cc2)c(-c2cccnc2)n1 |
InChI=1S/C20H21N5O/c1-25-13-16(19(24-25)14-8-10-21-11-9-14)12-22-17-4-6-18(7-5-17)23-20(26)15-2-3-15/h4-11,13,15,22H,2-3,12H2,1H3,(H,23,26) | Cn1cc(CNc2ccc(NC(=O)C3CC3)cc2)c(-c2ccncc2)n1 |
InChI=1S/C18H24N4O2/c1-12-17(13(2)22(21-12)9-10-23)11-19-15-5-7-16(8-6-15)20-18(24)14-3-4-14/h5-8,14,19,23H,3-4,9-11H2,1-2H3,(H,20,24) | Cc1nn(CCO)c(C)c1CNc1ccc(NC(=O)C2CC2)cc1 |
InChI=1S/C17H17N3O2S/c1-2-16-19-14(11-23-16)10-18-12-5-7-13(8-6-12)20-17(21)15-4-3-9-22-15/h3-9,11,18H,2,10H2,1H3,(H,20,21) | CCc1nc(CNc2ccc(NC(=O)c3ccco3)cc2)cs1 |
InChI=1S/C17H17N3OS2/c1-2-16-19-14(11-23-16)10-18-12-5-3-6-13(9-12)20-17(21)15-7-4-8-22-15/h3-9,11,18H,2,10H2,1H3,(H,20,21) | CCc1nc(CNc2cccc(NC(=O)c3cccs3)c2)cs1 |
InChI=1S/C19H25N3O2/c1-14-10-16(11-15(2)19(14)23-3)12-20-18-5-4-17(13-21-18)22-6-8-24-9-7-22/h4-5,10-11,13H,6-9,12H2,1-3H3,(H,20,21) | COc1c(C)cc(CNc2ccc(N3CCOCC3)cn2)cc1C |
InChI=1S/C15H20N4OS/c1-2-15-18-12(11-21-15)9-16-14-4-3-13(10-17-14)19-5-7-20-8-6-19/h3-4,10-11H,2,5-9H2,1H3,(H,16,17) | CCc1nc(CNc2ccc(N3CCOCC3)cn2)cs1 |
InChI=1S/C17H24N4OS/c1-17(2,3)16-20-13(12-23-16)10-18-15-5-4-14(11-19-15)21-6-8-22-9-7-21/h4-5,11-12H,6-10H2,1-3H3,(H,18,19) | CC(C)(C)c1nc(CNc2ccc(N3CCOCC3)cn2)cs1 |
InChI=1S/C19H20N4O2/c1-20-19(24)14-25-18-6-3-2-5-15(18)13-21-16-7-9-17(10-8-16)23-12-4-11-22-23/h2-12,21H,13-14H2,1H3,(H,20,24) | CNC(=O)COc1ccccc1CNc1ccc(-n2cccn2)cc1 |
InChI=1S/C15H16N4S/c1-2-15-18-13(11-20-15)10-16-12-4-6-14(7-5-12)19-9-3-8-17-19/h3-9,11,16H,2,10H2,1H3 | CCc1nc(CNc2ccc(-n3cccn3)cc2)cs1 |
InChI=1S/C19H18N6/c1-24-14-16(19(23-24)15-4-2-9-20-12-15)13-21-17-5-7-18(8-6-17)25-11-3-10-22-25/h2-12,14,21H,13H2,1H3 | Cn1cc(CNc2ccc(-n3cccn3)cc2)c(-c2cccnc2)n1 |
InChI=1S/C19H18N6/c1-24-14-16(19(23-24)15-7-10-20-11-8-15)13-21-17-3-5-18(6-4-17)25-12-2-9-22-25/h2-12,14,21H,13H2,1H3 | Cn1cc(CNc2ccc(-n3cccn3)cc2)c(-c2ccncc2)n1 |
InChI=1S/C19H20N4O2/c1-20-19(24)13-25-18-5-3-2-4-15(18)12-22-16-6-8-17(9-7-16)23-11-10-21-14-23/h2-11,14,22H,12-13H2,1H3,(H,20,24) | CNC(=O)COc1ccccc1CNc1ccc(-n2ccnc2)cc1 |
InChI=1S/C15H16N4S/c1-2-15-18-13(10-20-15)9-17-12-3-5-14(6-4-12)19-8-7-16-11-19/h3-8,10-11,17H,2,9H2,1H3 | CCc1nc(CNc2ccc(-n3ccnc3)cc2)cs1 |
InChI=1S/C17H14N4S2/c1-3-16(21-7-6-18-12-21)4-2-14(1)19-9-15-11-23-17(20-15)13-5-8-22-10-13/h1-8,10-12,19H,9H2 | c1cn(-c2ccc(NCc3csc(-c4ccsc4)n3)cc2)cn1 |
InChI=1S/C19H18N6/c1-24-13-16(19(23-24)15-3-2-8-20-11-15)12-22-17-4-6-18(7-5-17)25-10-9-21-14-25/h2-11,13-14,22H,12H2,1H3 | Cn1cc(CNc2ccc(-n3ccnc3)cc2)c(-c2cccnc2)n1 |
InChI=1S/C19H18N6/c1-24-13-16(19(23-24)15-6-8-20-9-7-15)12-22-17-2-4-18(5-3-17)25-11-10-21-14-25/h2-11,13-14,22H,12H2,1H3 | Cn1cc(CNc2ccc(-n3ccnc3)cc2)c(-c2ccncc2)n1 |
InChI=1S/C17H21N5O/c1-13-17(14(2)22(20-13)9-10-23)11-19-15-3-5-16(6-4-15)21-8-7-18-12-21/h3-8,12,19,23H,9-11H2,1-2H3 | Cc1nn(CCO)c(C)c1CNc1ccc(-n2ccnc2)cc1 |
InChI=1S/C17H20N4S/c1-17(2,3)16-20-14(11-22-16)10-19-13-4-6-15(7-5-13)21-9-8-18-12-21/h4-9,11-12,19H,10H2,1-3H3 | CC(C)(C)c1nc(CNc2ccc(-n3ccnc3)cc2)cs1 |
InChI=1S/C18H21FN2O2/c1-11-7-14(8-12(2)18(11)23-4)10-20-15-5-6-16(19)17(9-15)21-13(3)22/h5-9,20H,10H2,1-4H3,(H,21,22) | COc1c(C)cc(CNc2ccc(F)c(NC(C)=O)c2)cc1C |
InChI=1S/C18H20FN3O3/c1-12(23)22-16-9-14(7-8-15(16)19)21-10-13-5-3-4-6-17(13)25-11-18(24)20-2/h3-9,21H,10-11H2,1-2H3,(H,20,24)(H,22,23) | CNC(=O)COc1ccccc1CNc1ccc(F)c(NC(C)=O)c1 |
InChI=1S/C14H16FN3OS/c1-3-14-18-11(8-20-14)7-16-10-4-5-12(15)13(6-10)17-9(2)19/h4-6,8,16H,3,7H2,1-2H3,(H,17,19) | CCc1nc(CNc2ccc(F)c(NC(C)=O)c2)cs1 |
InChI=1S/C16H14FN3OS2/c1-10(21)19-15-6-12(2-3-14(15)17)18-7-13-9-23-16(20-13)11-4-5-22-8-11/h2-6,8-9,18H,7H2,1H3,(H,19,21) | CC(=O)Nc1cc(NCc2csc(-c3ccsc3)n2)ccc1F |
InChI=1S/C18H18FN5O/c1-12(25)22-17-8-15(5-6-16(17)19)21-10-14-11-24(2)23-18(14)13-4-3-7-20-9-13/h3-9,11,21H,10H2,1-2H3,(H,22,25) | CC(=O)Nc1cc(NCc2cn(C)nc2-c2cccnc2)ccc1F |
InChI=1S/C18H18FN5O/c1-12(25)22-17-9-15(3-4-16(17)19)21-10-14-11-24(2)23-18(14)13-5-7-20-8-6-13/h3-9,11,21H,10H2,1-2H3,(H,22,25) | CC(=O)Nc1cc(NCc2cn(C)nc2-c2ccncc2)ccc1F |
InChI=1S/C16H20FN3OS/c1-10(21)19-14-7-11(5-6-13(14)17)18-8-12-9-22-15(20-12)16(2,3)4/h5-7,9,18H,8H2,1-4H3,(H,19,21) | CC(=O)Nc1cc(NCc2csc(C(C)(C)C)n2)ccc1F |
InChI=1S/C17H15F3N4O/c1-24-11-13(16(23-24)12-4-3-7-21-9-12)10-22-14-5-2-6-15(8-14)25-17(18,19)20/h2-9,11,22H,10H2,1H3 | Cn1cc(CNc2cccc(OC(F)(F)F)c2)c(-c2cccnc2)n1 |
InChI=1S/C17H15F3N4O/c1-24-11-13(16(23-24)12-5-7-21-8-6-12)10-22-14-3-2-4-15(9-14)25-17(18,19)20/h2-9,11,22H,10H2,1H3 | Cn1cc(CNc2cccc(OC(F)(F)F)c2)c(-c2ccncc2)n1 |
InChI=1S/C17H23N3OS/c1-4-17-20-15(11-22-17)10-18-13-5-7-14(8-6-13)19-16(21)9-12(2)3/h5-8,11-12,18H,4,9-10H2,1-3H3,(H,19,21) | CCc1nc(CNc2ccc(NC(=O)CC(C)C)cc2)cs1 |
InChI=1S/C13H14F2N2OS/c1-2-12-17-10(8-19-12)7-16-9-4-3-5-11(6-9)18-13(14)15/h3-6,8,13,16H,2,7H2,1H3 | CCc1nc(CNc2cccc(OC(F)F)c2)cs1 |
InChI=1S/C17H16F2N4O/c1-23-11-13(16(22-23)12-4-3-7-20-9-12)10-21-14-5-2-6-15(8-14)24-17(18)19/h2-9,11,17,21H,10H2,1H3 | Cn1cc(CNc2cccc(OC(F)F)c2)c(-c2cccnc2)n1 |
InChI=1S/C17H16F2N4O/c1-23-11-13(16(22-23)12-5-7-20-8-6-12)10-21-14-3-2-4-15(9-14)24-17(18)19/h2-9,11,17,21H,10H2,1H3 | Cn1cc(CNc2cccc(OC(F)F)c2)c(-c2ccncc2)n1 |
InChI=1S/C18H20N4O/c1-3-23-17-8-4-7-16(10-17)20-12-15-13-22(2)21-18(15)14-6-5-9-19-11-14/h4-11,13,20H,3,12H2,1-2H3 | CCOc1cccc(NCc2cn(C)nc2-c2cccnc2)c1 |
InChI=1S/C18H20N4O/c1-3-23-17-6-4-5-16(11-17)20-12-15-13-22(2)21-18(15)14-7-9-19-10-8-14/h4-11,13,20H,3,12H2,1-2H3 | CCOc1cccc(NCc2cn(C)nc2-c2ccncc2)c1 |
InChI=1S/C19H21N3O3/c1-20-19(24)12-25-17-5-3-2-4-14(17)11-21-15-7-8-16-13(10-15)6-9-18(23)22-16/h2-5,7-8,10,21H,6,9,11-12H2,1H3,(H,20,24)(H,22,23) | CNC(=O)COc1ccccc1CNc1ccc2c(c1)CCC(=O)N2 |
InChI=1S/C15H17N3OS/c1-2-15-17-12(9-20-15)8-16-11-4-5-13-10(7-11)3-6-14(19)18-13/h4-5,7,9,16H,2-3,6,8H2,1H3,(H,18,19) | CCc1nc(CNc2ccc3c(c2)CCC(=O)N3)cs1 |
InChI=1S/C19H19N5O/c1-24-12-15(19(23-24)14-3-2-8-20-10-14)11-21-16-5-6-17-13(9-16)4-7-18(25)22-17/h2-3,5-6,8-10,12,21H,4,7,11H2,1H3,(H,22,25) | Cn1cc(CNc2ccc3c(c2)CCC(=O)N3)c(-c2cccnc2)n1 |
InChI=1S/C19H19N5O/c1-24-12-15(19(23-24)13-6-8-20-9-7-13)11-21-16-3-4-17-14(10-16)2-5-18(25)22-17/h3-4,6-10,12,21H,2,5,11H2,1H3,(H,22,25) | Cn1cc(CNc2ccc3c(c2)CCC(=O)N3)c(-c2ccncc2)n1 |
InChI=1S/C17H22N4O2/c1-11-15(12(2)21(20-11)7-8-22)10-18-14-4-5-16-13(9-14)3-6-17(23)19-16/h4-5,9,18,22H,3,6-8,10H2,1-2H3,(H,19,23) | Cc1nn(CCO)c(C)c1CNc1ccc2c(c1)CCC(=O)N2 |
InChI=1S/C17H21N3OS/c1-17(2,3)16-19-13(10-22-16)9-18-12-5-6-14-11(8-12)4-7-15(21)20-14/h5-6,8,10,18H,4,7,9H2,1-3H3,(H,20,21) | CC(C)(C)c1nc(CNc2ccc3c(c2)CCC(=O)N3)cs1 |
InChI=1S/C16H21N3OS/c1-4-15-18-14(10-21-15)9-17-12-6-5-7-13(8-12)19-16(20)11(2)3/h5-8,10-11,17H,4,9H2,1-3H3,(H,19,20) | CCc1nc(CNc2cccc(NC(=O)C(C)C)c2)cs1 |
InChI=1S/C20H23N5O/c1-14(2)20(26)23-18-8-4-7-17(10-18)22-12-16-13-25(3)24-19(16)15-6-5-9-21-11-15/h4-11,13-14,22H,12H2,1-3H3,(H,23,26) | CC(C)C(=O)Nc1cccc(NCc2cn(C)nc2-c2cccnc2)c1 |
InChI=1S/C20H23N5O/c1-14(2)20(26)23-18-6-4-5-17(11-18)22-12-16-13-25(3)24-19(16)15-7-9-21-10-8-15/h4-11,13-14,22H,12H2,1-3H3,(H,23,26) | CC(C)C(=O)Nc1cccc(NCc2cn(C)nc2-c2ccncc2)c1 |
InChI=1S/C19H23N3O3/c1-13-8-9-16(10-17(13)22-14(2)23)21-11-15-6-4-5-7-18(15)25-12-19(24)20-3/h4-10,21H,11-12H2,1-3H3,(H,20,24)(H,22,23) | CNC(=O)COc1ccccc1CNc1ccc(C)c(NC(C)=O)c1 |
InChI=1S/C15H19N3OS/c1-4-15-18-13(9-20-15)8-16-12-6-5-10(2)14(7-12)17-11(3)19/h5-7,9,16H,4,8H2,1-3H3,(H,17,19) | CCc1nc(CNc2ccc(C)c(NC(C)=O)c2)cs1 |
InChI=1S/C17H17N3OS2/c1-11-3-4-14(7-16(11)19-12(2)21)18-8-15-10-23-17(20-15)13-5-6-22-9-13/h3-7,9-10,18H,8H2,1-2H3,(H,19,21) | CC(=O)Nc1cc(NCc2csc(-c3ccsc3)n2)ccc1C |
InChI=1S/C19H21N5O/c1-13-6-7-17(9-18(13)22-14(2)25)21-11-16-12-24(3)23-19(16)15-5-4-8-20-10-15/h4-10,12,21H,11H2,1-3H3,(H,22,25) | CC(=O)Nc1cc(NCc2cn(C)nc2-c2cccnc2)ccc1C |
InChI=1S/C19H21N5O/c1-13-4-5-17(10-18(13)22-14(2)25)21-11-16-12-24(3)23-19(16)15-6-8-20-9-7-15/h4-10,12,21H,11H2,1-3H3,(H,22,25) | CC(=O)Nc1cc(NCc2cn(C)nc2-c2ccncc2)ccc1C |
InChI=1S/C17H24N4O2/c1-11-5-6-15(9-17(11)19-14(4)23)18-10-16-12(2)20-21(7-8-22)13(16)3/h5-6,9,18,22H,7-8,10H2,1-4H3,(H,19,23) | CC(=O)Nc1cc(NCc2c(C)nn(CCO)c2C)ccc1C |
InChI=1S/C17H23N3OS/c1-11-6-7-13(8-15(11)19-12(2)21)18-9-14-10-22-16(20-14)17(3,4)5/h6-8,10,18H,9H2,1-5H3,(H,19,21) | CC(=O)Nc1cc(NCc2csc(C(C)(C)C)n2)ccc1C |
InChI=1S/C18H22N2O2/c1-12-8-15(9-13(2)18(12)22-3)11-20-16-6-4-14(5-7-16)10-17(19)21/h4-9,20H,10-11H2,1-3H3,(H2,19,21) | COc1c(C)cc(CNc2ccc(CC(N)=O)cc2)cc1C |
InChI=1S/C14H17N3OS/c1-2-14-17-12(9-19-14)8-16-11-5-3-10(4-6-11)7-13(15)18/h3-6,9,16H,2,7-8H2,1H3,(H2,15,18) | CCc1nc(CNc2ccc(CC(N)=O)cc2)cs1 |
InChI=1S/C16H15N3OS2/c17-15(20)7-11-1-3-13(4-2-11)18-8-14-10-22-16(19-14)12-5-6-21-9-12/h1-6,9-10,18H,7-8H2,(H2,17,20) | NC(=O)Cc1ccc(NCc2csc(-c3ccsc3)n2)cc1 |
InChI=1S/C18H19N5O/c1-23-12-15(18(22-23)14-3-2-8-20-10-14)11-21-16-6-4-13(5-7-16)9-17(19)24/h2-8,10,12,21H,9,11H2,1H3,(H2,19,24) | Cn1cc(CNc2ccc(CC(N)=O)cc2)c(-c2cccnc2)n1 |
InChI=1S/C18H19N5O/c1-23-12-15(18(22-23)14-6-8-20-9-7-14)11-21-16-4-2-13(3-5-16)10-17(19)24/h2-9,12,21H,10-11H2,1H3,(H2,19,24) | Cn1cc(CNc2ccc(CC(N)=O)cc2)c(-c2ccncc2)n1 |
InChI=1S/C16H21N3OS/c1-16(2,3)15-19-13(10-21-15)9-18-12-6-4-11(5-7-12)8-14(17)20/h4-7,10,18H,8-9H2,1-3H3,(H2,17,20) | CC(C)(C)c1nc(CNc2ccc(CC(N)=O)cc2)cs1 |
InChI=1S/C17H23N3OS/c1-4-17-20-15(11-22-17)10-18-14-7-5-13(6-8-14)9-16(21)19-12(2)3/h5-8,11-12,18H,4,9-10H2,1-3H3,(H,19,21) | CCc1nc(CNc2ccc(CC(=O)NC(C)C)cc2)cs1 |
InChI=1S/C19H24N2O3/c1-12-8-15(9-13(2)19(12)24-5)11-20-16-6-7-17(21-14(3)22)18(10-16)23-4/h6-10,20H,11H2,1-5H3,(H,21,22) | COc1cc(NCc2cc(C)c(OC)c(C)c2)ccc1NC(C)=O |
InChI=1S/C15H19N3O2S/c1-4-15-18-12(9-21-15)8-16-11-5-6-13(17-10(2)19)14(7-11)20-3/h5-7,9,16H,4,8H2,1-3H3,(H,17,19) | CCc1nc(CNc2ccc(NC(C)=O)c(OC)c2)cs1 |
InChI=1S/C17H24N4O3/c1-11-15(12(2)21(20-11)7-8-22)10-18-14-5-6-16(19-13(3)23)17(9-14)24-4/h5-6,9,18,22H,7-8,10H2,1-4H3,(H,19,23) | COc1cc(NCc2c(C)nn(CCO)c2C)ccc1NC(C)=O |
InChI=1S/C17H23N3O2S/c1-11(21)19-14-7-6-12(8-15(14)22-5)18-9-13-10-23-16(20-13)17(2,3)4/h6-8,10,18H,9H2,1-5H3,(H,19,21) | COc1cc(NCc2csc(C(C)(C)C)n2)ccc1NC(C)=O |
InChI=1S/C18H19N3OS/c1-2-18-21-16(13-23-18)11-20-15-6-3-7-17(9-15)22-12-14-5-4-8-19-10-14/h3-10,13,20H,2,11-12H2,1H3 | CCc1nc(CNc2cccc(OCc3cccnc3)c2)cs1 |
InChI=1S/C19H24N2O2/c1-13-9-16(10-14(2)19(13)23-4)12-21-17-7-5-15(6-8-17)11-18(22)20-3/h5-10,21H,11-12H2,1-4H3,(H,20,22) | CNC(=O)Cc1ccc(NCc2cc(C)c(OC)c(C)c2)cc1 |
InChI=1S/C15H19N3OS/c1-3-15-18-13(10-20-15)9-17-12-6-4-11(5-7-12)8-14(19)16-2/h4-7,10,17H,3,8-9H2,1-2H3,(H,16,19) | CCc1nc(CNc2ccc(CC(=O)NC)cc2)cs1 |
InChI=1S/C17H17N3OS2/c1-18-16(21)8-12-2-4-14(5-3-12)19-9-15-11-23-17(20-15)13-6-7-22-10-13/h2-7,10-11,19H,8-9H2,1H3,(H,18,21) | CNC(=O)Cc1ccc(NCc2csc(-c3ccsc3)n2)cc1 |
InChI=1S/C19H21N5O/c1-20-18(25)10-14-5-7-17(8-6-14)22-12-16-13-24(2)23-19(16)15-4-3-9-21-11-15/h3-9,11,13,22H,10,12H2,1-2H3,(H,20,25) | CNC(=O)Cc1ccc(NCc2cn(C)nc2-c2cccnc2)cc1 |
InChI=1S/C19H21N5O/c1-20-18(25)11-14-3-5-17(6-4-14)22-12-16-13-24(2)23-19(16)15-7-9-21-10-8-15/h3-10,13,22H,11-12H2,1-2H3,(H,20,25) | CNC(=O)Cc1ccc(NCc2cn(C)nc2-c2ccncc2)cc1 |
InChI=1S/C17H23N3OS/c1-17(2,3)16-20-14(11-22-16)10-19-13-7-5-12(6-8-13)9-15(21)18-4/h5-8,11,19H,9-10H2,1-4H3,(H,18,21) | CNC(=O)Cc1ccc(NCc2csc(C(C)(C)C)n2)cc1 |
InChI=1S/C20H24N4O/c1-15(2)14-25-19-8-4-7-18(10-19)22-12-17-13-24(3)23-20(17)16-6-5-9-21-11-16/h4-11,13,15,22H,12,14H2,1-3H3 | CC(C)COc1cccc(NCc2cn(C)nc2-c2cccnc2)c1 |
InChI=1S/C20H24N4O/c1-15(2)14-25-19-6-4-5-18(11-19)22-12-17-13-24(3)23-20(17)16-7-9-21-10-8-16/h4-11,13,15,22H,12,14H2,1-3H3 | CC(C)COc1cccc(NCc2cn(C)nc2-c2ccncc2)c1 |
InChI=1S/C21H24N4O/c1-25-15-17(21(24-25)16-9-11-22-12-10-16)14-23-18-5-4-8-20(13-18)26-19-6-2-3-7-19/h4-5,8-13,15,19,23H,2-3,6-7,14H2,1H3 | Cn1cc(CNc2cccc(OC3CCCC3)c2)c(-c2ccncc2)n1 |
InChI=1S/C19H22N4O/c1-3-10-24-18-8-4-7-17(11-18)21-13-16-14-23(2)22-19(16)15-6-5-9-20-12-15/h4-9,11-12,14,21H,3,10,13H2,1-2H3 | CCCOc1cccc(NCc2cn(C)nc2-c2cccnc2)c1 |
InChI=1S/C19H22N4O/c1-3-11-24-18-6-4-5-17(12-18)21-13-16-14-23(2)22-19(16)15-7-9-20-10-8-15/h4-10,12,14,21H,3,11,13H2,1-2H3 | CCCOc1cccc(NCc2cn(C)nc2-c2ccncc2)c1 |
InChI=1S/C17H21N3OS/c1-2-16-19-15(12-22-16)10-18-14-7-5-13(6-8-14)11-20-9-3-4-17(20)21/h5-8,12,18H,2-4,9-11H2,1H3 | CCc1nc(CNc2ccc(CN3CCCC3=O)cc2)cs1 |
InChI=1S/C19H25N3OS/c1-19(2,3)18-21-16(13-24-18)11-20-15-8-6-14(7-9-15)12-22-10-4-5-17(22)23/h6-9,13,20H,4-5,10-12H2,1-3H3 | CC(C)(C)c1nc(CNc2ccc(CN3CCCC3=O)cc2)cs1 |
InChI=1S/C20H26N2O2/c1-14-10-17(11-15(2)20(14)24-5)13-21-18-8-6-16(7-9-18)12-19(23)22(3)4/h6-11,21H,12-13H2,1-5H3 | COc1c(C)cc(CNc2ccc(CC(=O)N(C)C)cc2)cc1C |
InChI=1S/C16H21N3OS/c1-4-15-18-14(11-21-15)10-17-13-7-5-12(6-8-13)9-16(20)19(2)3/h5-8,11,17H,4,9-10H2,1-3H3 | CCc1nc(CNc2ccc(CC(=O)N(C)C)cc2)cs1 |
InChI=1S/C20H23N5O/c1-24(2)19(26)11-15-6-8-18(9-7-15)22-13-17-14-25(3)23-20(17)16-5-4-10-21-12-16/h4-10,12,14,22H,11,13H2,1-3H3 | CN(C)C(=O)Cc1ccc(NCc2cn(C)nc2-c2cccnc2)cc1 |
InChI=1S/C20H23N5O/c1-24(2)19(26)12-15-4-6-18(7-5-15)22-13-17-14-25(3)23-20(17)16-8-10-21-11-9-16/h4-11,14,22H,12-13H2,1-3H3 | CN(C)C(=O)Cc1ccc(NCc2cn(C)nc2-c2ccncc2)cc1 |
InChI=1S/C18H26N4O2/c1-13-17(14(2)22(20-13)9-10-23)12-19-16-7-5-15(6-8-16)11-18(24)21(3)4/h5-8,19,23H,9-12H2,1-4H3 | Cc1nn(CCO)c(C)c1CNc1ccc(CC(=O)N(C)C)cc1 |
InChI=1S/C18H25N3OS/c1-18(2,3)17-20-15(12-23-17)11-19-14-8-6-13(7-9-14)10-16(22)21(4)5/h6-9,12,19H,10-11H2,1-5H3 | CN(C)C(=O)Cc1ccc(NCc2csc(C(C)(C)C)n2)cc1 |
InChI=1S/C16H16N4OS/c1-2-16-20-13(11-22-16)9-19-12-4-3-5-14(8-12)21-15-10-17-6-7-18-15/h3-8,10-11,19H,2,9H2,1H3 | CCc1nc(CNc2cccc(Oc3cnccn3)c2)cs1 |
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