inchi stringlengths 33 163 | smiles stringlengths 15 57 |
|---|---|
InChI=1S/C17H17NO4/c1-10-9-22-11(2)15(10)14(19)8-17(21)12-6-4-5-7-13(12)18(3)16(17)20/h4-7,9,21H,8H2,1-3H3 | Cc1coc(C)c1C(=O)CC1(O)C(=O)N(C)c2ccccc21 |
InChI=1S/C15H17NO4S/c1-18-11-7-10(8-12(19-2)14(11)20-3)9-16-15(17)13-5-4-6-21-13/h4-8H,9H2,1-3H3,(H,16,17) | COc1cc(CNC(=O)c2cccs2)cc(OC)c1OC |
InChI=1S/C17H14N2O/c1-12-4-2-5-14(10-12)17(20)19-15-7-8-16-13(11-15)6-3-9-18-16/h2-11H,1H3,(H,19,20) | Cc1cccc(C(=O)Nc2ccc3ncccc3c2)c1 |
InChI=1S/C21H24N2O2/c1-4-21(25)22-15(2)14-20(18-12-8-9-13-19(18)22)23(16(3)24)17-10-6-5-7-11-17/h5-13,15,20H,4,14H2,1-3H3 | CCC(=O)N1c2ccccc2C(N(C(C)=O)c2ccccc2)CC1C |
InChI=1S/C18H20N2O2/c1-14(21)20-17(12-15-8-4-2-5-9-15)18(22)19-13-16-10-6-3-7-11-16/h2-11,17H,12-13H2,1H3,(H,19,22)(H,20,21) | CC(=O)NC(Cc1ccccc1)C(=O)NCc1ccccc1 |
InChI=1S/C15H13N3O2/c1-10-9-14(18-20-10)17-15(19)16-13-8-4-6-11-5-2-3-7-12(11)13/h2-9H,1H3,(H2,16,17,18,19) | Cc1cc(NC(=O)Nc2cccc3ccccc23)no1 |
InChI=1S/C16H11FN2O/c17-13-6-3-5-12(8-13)16(20)19-14-9-11-4-1-2-7-15(11)18-10-14/h1-10H,(H,19,20) | O=C(Nc1cnc2ccccc2c1)c1cccc(F)c1 |
InChI=1S/C13H8ClF3N2O/c14-10-2-1-9(13(15,16)17)7-11(10)19-12(20)8-3-5-18-6-4-8/h1-7H,(H,19,20) | O=C(Nc1cc(C(F)(F)F)ccc1Cl)c1ccncc1 |
InChI=1S/C15H16N2OS/c1-11-6-7-13(9-12(11)2)17-14(18)10-19-15-5-3-4-8-16-15/h3-9H,10H2,1-2H3,(H,17,18) | Cc1ccc(NC(=O)CSc2ccccn2)cc1C |
InChI=1S/C13H16N4OS/c1-9-4-5-11(6-10(9)2)15-12(18)7-19-13-16-14-8-17(13)3/h4-6,8H,7H2,1-3H3,(H,15,18) | Cc1ccc(NC(=O)CSc2nncn2C)cc1C |
InChI=1S/C13H10ClFN2OS/c14-10-7-9(4-5-11(10)15)17-12(18)8-19-13-3-1-2-6-16-13/h1-7H,8H2,(H,17,18) | O=C(CSc1ccccn1)Nc1ccc(F)c(Cl)c1 |
InChI=1S/C14H11F3N2OS/c15-14(16,17)10-4-3-5-11(8-10)19-12(20)9-21-13-6-1-2-7-18-13/h1-8H,9H2,(H,19,20) | O=C(CSc1ccccn1)Nc1cccc(C(F)(F)F)c1 |
InChI=1S/C11H12FN5OS/c1-7-3-4-8(12)5-9(7)13-10(18)6-19-11-14-15-16-17(11)2/h3-5H,6H2,1-2H3,(H,13,18) | Cc1ccc(F)cc1NC(=O)CSc1nnnn1C |
InChI=1S/C10H9Cl2N5OS/c1-17-10(14-15-16-17)19-5-9(18)13-6-2-3-7(11)8(12)4-6/h2-4H,5H2,1H3,(H,13,18) | Cn1nnnc1SCC(=O)Nc1ccc(Cl)c(Cl)c1 |
InChI=1S/C13H11BrN2OS/c14-10-5-1-2-6-11(10)16-12(17)9-18-13-7-3-4-8-15-13/h1-8H,9H2,(H,16,17) | O=C(CSc1ccccn1)Nc1ccccc1Br |
InChI=1S/C11H10F3N5OS/c1-19-10(16-17-18-19)21-6-9(20)15-8-4-2-3-7(5-8)11(12,13)14/h2-5H,6H2,1H3,(H,15,20) | Cn1nnnc1SCC(=O)Nc1cccc(C(F)(F)F)c1 |
InChI=1S/C10H9ClFN5OS/c1-17-10(14-15-16-17)19-5-9(18)13-6-2-3-8(12)7(11)4-6/h2-4H,5H2,1H3,(H,13,18) | Cn1nnnc1SCC(=O)Nc1ccc(F)c(Cl)c1 |
InChI=1S/C14H13ClN2O2S/c1-19-12-6-5-10(15)8-11(12)17-13(18)9-20-14-4-2-3-7-16-14/h2-8H,9H2,1H3,(H,17,18) | COc1ccc(Cl)cc1NC(=O)CSc1ccccn1 |
InChI=1S/C12H14N4OS/c1-9-3-5-10(6-4-9)14-11(17)7-18-12-15-13-8-16(12)2/h3-6,8H,7H2,1-2H3,(H,14,17) | Cc1ccc(NC(=O)CSc2nncn2C)cc1 |
InChI=1S/C15H16N2OS/c1-11-6-5-7-13(12(11)2)17-14(18)10-19-15-8-3-4-9-16-15/h3-9H,10H2,1-2H3,(H,17,18) | Cc1cccc(NC(=O)CSc2ccccn2)c1C |
InChI=1S/C15H16N2O2S/c1-11-6-7-13(19-2)12(9-11)17-14(18)10-20-15-5-3-4-8-16-15/h3-9H,10H2,1-2H3,(H,17,18) | COc1ccc(C)cc1NC(=O)CSc1ccccn1 |
InChI=1S/C14H19N5OS/c1-4-10(2)11-5-7-12(8-6-11)15-13(20)9-21-14-16-17-18-19(14)3/h5-8,10H,4,9H2,1-3H3,(H,15,20) | CCC(C)c1ccc(NC(=O)CSc2nnnn2C)cc1 |
InChI=1S/C15H20N4OS/c1-4-11(2)12-5-7-13(8-6-12)17-14(20)9-21-15-18-16-10-19(15)3/h5-8,10-11H,4,9H2,1-3H3,(H,17,20) | CCC(C)c1ccc(NC(=O)CSc2nncn2C)cc1 |
InChI=1S/C13H12N4OS/c1-17-7-6-15-13(17)19-9-12(18)16-11-5-3-2-4-10(11)8-14/h2-7H,9H2,1H3,(H,16,18) | Cn1ccnc1SCC(=O)Nc1ccccc1C#N |
InChI=1S/C13H15N3O2S2/c1-3-18-11-6-4-10(5-7-11)14-12(17)8-19-13-16-15-9(2)20-13/h4-7H,3,8H2,1-2H3,(H,14,17) | CCOc1ccc(NC(=O)CSc2nnc(C)s2)cc1 |
InChI=1S/C12H10ClN3OS/c13-9-3-1-4-10(7-9)16-11(17)8-18-12-14-5-2-6-15-12/h1-7H,8H2,(H,16,17) | O=C(CSc1ncccn1)Nc1cccc(Cl)c1 |
InChI=1S/C11H11ClN4OS/c1-16-7-13-15-11(16)18-6-10(17)14-9-4-2-3-8(12)5-9/h2-5,7H,6H2,1H3,(H,14,17) | Cn1cnnc1SCC(=O)Nc1cccc(Cl)c1 |
InChI=1S/C15H12ClN5OS/c16-11-5-4-6-12(9-11)17-14(22)10-23-15-18-19-20-21(15)13-7-2-1-3-8-13/h1-9H,10H2,(H,17,22) | O=C(CSc1nnnn1-c1ccccc1)Nc1cccc(Cl)c1 |
InChI=1S/C11H11Cl2NO3/c1-17-11(16)5-4-10(15)14-7-2-3-8(12)9(13)6-7/h2-3,6H,4-5H2,1H3,(H,14,15) | COC(=O)CCC(=O)Nc1ccc(Cl)c(Cl)c1 |
InChI=1S/C13H15N3OS2/c1-8-4-9(2)6-11(5-8)14-12(17)7-18-13-16-15-10(3)19-13/h4-6H,7H2,1-3H3,(H,14,17) | Cc1cc(C)cc(NC(=O)CSc2nnc(C)s2)c1 |
InChI=1S/C13H16N4OS/c1-9-4-10(2)6-11(5-9)15-12(18)7-19-13-16-14-8-17(13)3/h4-6,8H,7H2,1-3H3,(H,15,18) | Cc1cc(C)cc(NC(=O)CSc2nncn2C)c1 |
InChI=1S/C17H17N5OS/c1-12-8-13(2)10-14(9-12)18-16(23)11-24-17-19-20-21-22(17)15-6-4-3-5-7-15/h3-10H,11H2,1-2H3,(H,18,23) | Cc1cc(C)cc(NC(=O)CSc2nnnn2-c2ccccc2)c1 |
InChI=1S/C15H16N2OS/c1-11-7-12(2)9-13(8-11)17-14(18)10-19-15-5-3-4-6-16-15/h3-9H,10H2,1-2H3,(H,17,18) | Cc1cc(C)cc(NC(=O)CSc2ccccn2)c1 |
InChI=1S/C13H11FN2OS/c14-10-4-6-11(7-5-10)16-12(17)9-18-13-3-1-2-8-15-13/h1-8H,9H2,(H,16,17) | O=C(CSc1ccccn1)Nc1ccc(F)cc1 |
InChI=1S/C12H12FN3OS/c1-16-7-6-14-12(16)18-8-11(17)15-10-4-2-9(13)3-5-10/h2-7H,8H2,1H3,(H,15,17) | Cn1ccnc1SCC(=O)Nc1ccc(F)cc1 |
InChI=1S/C11H11FN4OS/c1-16-7-13-15-11(16)18-6-10(17)14-9-4-2-8(12)3-5-9/h2-5,7H,6H2,1H3,(H,14,17) | Cn1cnnc1SCC(=O)Nc1ccc(F)cc1 |
InChI=1S/C11H10FN3OS2/c1-7-14-15-11(18-7)17-6-10(16)13-9-4-2-8(12)3-5-9/h2-5H,6H2,1H3,(H,13,16) | Cc1nnc(SCC(=O)Nc2ccc(F)cc2)s1 |
InChI=1S/C11H9F2N3OS2/c1-6-15-16-11(19-6)18-5-10(17)14-9-3-2-7(12)4-8(9)13/h2-4H,5H2,1H3,(H,14,17) | Cc1nnc(SCC(=O)Nc2ccc(F)cc2F)s1 |
InChI=1S/C14H13F2N3OS/c1-8-5-9(2)18-14(17-8)21-7-13(20)19-12-4-3-10(15)6-11(12)16/h3-6H,7H2,1-2H3,(H,19,20) | Cc1cc(C)nc(SCC(=O)Nc2ccc(F)cc2F)n1 |
InChI=1S/C12H14N4O2S/c1-16-8-13-15-12(16)19-7-11(17)14-9-3-5-10(18-2)6-4-9/h3-6,8H,7H2,1-2H3,(H,14,17) | COc1ccc(NC(=O)CSc2nncn2C)cc1 |
InChI=1S/C12H13N3O2S2/c1-8-14-15-12(19-8)18-7-11(16)13-9-3-5-10(17-2)6-4-9/h3-6H,7H2,1-2H3,(H,13,16) | COc1ccc(NC(=O)CSc2nnc(C)s2)cc1 |
InChI=1S/C13H13N3O2S/c1-18-11-5-3-10(4-6-11)16-12(17)9-19-13-14-7-2-8-15-13/h2-8H,9H2,1H3,(H,16,17) | COc1ccc(NC(=O)CSc2ncccn2)cc1 |
InChI=1S/C15H10F2N2O/c1-9-18-13-5-3-2-4-11(13)15(20)19(9)14-8-10(16)6-7-12(14)17/h2-8H,1H3 | Cc1nc2ccccc2c(=O)n1-c1cc(F)ccc1F |
InChI=1S/C15H9F3N2O/c1-8-19-11-5-3-2-4-9(11)15(21)20(8)12-7-6-10(16)13(17)14(12)18/h2-7H,1H3 | Cc1nc2ccccc2c(=O)n1-c1ccc(F)c(F)c1F |
InChI=1S/C10H9F2N5OS/c1-17-10(14-15-16-17)19-5-9(18)13-8-4-6(11)2-3-7(8)12/h2-4H,5H2,1H3,(H,13,18) | Cn1nnnc1SCC(=O)Nc1cc(F)ccc1F |
InChI=1S/C16H13F3N2O2/c17-10-1-4-12(5-2-10)20-15(22)7-8-16(23)21-14-6-3-11(18)9-13(14)19/h1-6,9H,7-8H2,(H,20,22)(H,21,23) | O=C(CCC(=O)Nc1ccc(F)cc1F)Nc1ccc(F)cc1 |
InChI=1S/C20H21NO2/c22-19(15-16-9-3-1-4-10-16)17-11-5-6-12-18(17)20(23)21-13-7-2-8-14-21/h1,3-6,9-12H,2,7-8,13-15H2 | O=C(Cc1ccccc1)c1ccccc1C(=O)N1CCCCC1 |
InChI=1S/C11H10F2N4OS/c1-17-6-14-16-11(17)19-5-10(18)15-9-4-7(12)2-3-8(9)13/h2-4,6H,5H2,1H3,(H,15,18) | Cn1cnnc1SCC(=O)Nc1cc(F)ccc1F |
InChI=1S/C19H19NO3/c21-18(14-15-6-2-1-3-7-15)16-8-4-5-9-17(16)19(22)20-10-12-23-13-11-20/h1-9H,10-14H2 | O=C(Cc1ccccc1)c1ccccc1C(=O)N1CCOCC1 |
InChI=1S/C14H13ClN2OS/c1-10-5-6-11(8-12(10)15)17-13(18)9-19-14-4-2-3-7-16-14/h2-8H,9H2,1H3,(H,17,18) | Cc1ccc(NC(=O)CSc2ccccn2)cc1Cl |
InChI=1S/C14H11F2NOS/c15-10-1-5-12(6-2-10)17-14(18)9-19-13-7-3-11(16)4-8-13/h1-8H,9H2,(H,17,18) | O=C(CSc1ccc(F)cc1)Nc1ccc(F)cc1 |
InChI=1S/C17H17N5OS/c1-12-7-6-10-15(13(12)2)18-16(23)11-24-17-19-20-21-22(17)14-8-4-3-5-9-14/h3-10H,11H2,1-2H3,(H,18,23) | Cc1cccc(NC(=O)CSc2nnnn2-c2ccccc2)c1C |
InChI=1S/C14H10ClN3O/c15-11-7-3-1-5-9(11)13-17-12-8-4-2-6-10(12)14(19)18(13)16/h1-8H,16H2 | Nn1c(-c2ccccc2Cl)nc2ccccc2c1=O |
InChI=1S/C14H17N3OS/c1-10-5-4-6-12(11(10)2)16-13(18)9-19-14-15-7-8-17(14)3/h4-8H,9H2,1-3H3,(H,16,18) | Cc1cccc(NC(=O)CSc2nccn2C)c1C |
InChI=1S/C13H14N2O4/c1-8-4-12(15-19-8)14-13(16)9-5-10(17-2)7-11(6-9)18-3/h4-7H,1-3H3,(H,14,15,16) | COc1cc(OC)cc(C(=O)Nc2cc(C)on2)c1 |
InChI=1S/C18H20N2O2/c1-12-5-6-15(11-13(12)2)18(22)19-16-7-9-17(10-8-16)20(4)14(3)21/h5-11H,1-4H3,(H,19,22) | CC(=O)N(C)c1ccc(NC(=O)c2ccc(C)c(C)c2)cc1 |
InChI=1S/C17H23NO3/c1-4-21-17(20)15-6-5-9-18(11-15)16(19)14-8-7-12(2)13(3)10-14/h7-8,10,15H,4-6,9,11H2,1-3H3 | CCOC(=O)C1CCCN(C(=O)c2ccc(C)c(C)c2)C1 |
InChI=1S/C16H21NO3/c1-11-4-5-14(10-12(11)2)15(18)17-8-6-13(7-9-17)16(19)20-3/h4-5,10,13H,6-9H2,1-3H3 | COC(=O)C1CCN(C(=O)c2ccc(C)c(C)c2)CC1 |
InChI=1S/C17H17NO3/c1-11-3-5-14(7-12(11)2)17(19)18-9-13-4-6-15-16(8-13)21-10-20-15/h3-8H,9-10H2,1-2H3,(H,18,19) | Cc1ccc(C(=O)NCc2ccc3c(c2)OCO3)cc1C |
InChI=1S/C18H20N2O3/c1-4-23-17-11-5-14(6-12-17)18(22)19-15-7-9-16(10-8-15)20(3)13(2)21/h5-12H,4H2,1-3H3,(H,19,22) | CCOc1ccc(C(=O)Nc2ccc(N(C)C(C)=O)cc2)cc1 |
InChI=1S/C17H23NO4/c1-3-21-15-9-7-13(8-10-15)16(19)18-11-5-6-14(12-18)17(20)22-4-2/h7-10,14H,3-6,11-12H2,1-2H3 | CCOC(=O)C1CCCN(C(=O)c2ccc(OCC)cc2)C1 |
InChI=1S/C14H14N2O3/c1-10(17)16(2)12-7-5-11(6-8-12)15-14(18)13-4-3-9-19-13/h3-9H,1-2H3,(H,15,18) | CC(=O)N(C)c1ccc(NC(=O)c2ccco2)cc1 |
InChI=1S/C17H20N2O2/c1-13-5-3-6-15(14(13)2)18-8-10-19(11-9-18)17(20)16-7-4-12-21-16/h3-7,12H,8-11H2,1-2H3 | Cc1cccc(N2CCN(C(=O)c3ccco3)CC2)c1C |
InChI=1S/C16H18N2O4S/c1-22-14-4-2-3-13(11-14)16(19)18-10-9-12-5-7-15(8-6-12)23(17,20)21/h2-8,11H,9-10H2,1H3,(H,18,19)(H2,17,20,21) | COc1cccc(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)c1 |
InChI=1S/C17H18N2O3/c1-12(20)19(2)15-9-7-14(8-10-15)18-17(21)13-5-4-6-16(11-13)22-3/h4-11H,1-3H3,(H,18,21) | COc1cccc(C(=O)Nc2ccc(N(C)C(C)=O)cc2)c1 |
InChI=1S/C15H19NO4/c1-19-13-5-3-4-12(10-13)14(17)16-8-6-11(7-9-16)15(18)20-2/h3-5,10-11H,6-9H2,1-2H3 | COC(=O)C1CCN(C(=O)c2cccc(OC)c2)CC1 |
InChI=1S/C17H14N2O2/c1-12-11-16(19-21-12)18-17(20)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-11H,1H3,(H,18,19,20) | Cc1cc(NC(=O)c2ccc(-c3ccccc3)cc2)no1 |
InChI=1S/C20H21NO3/c1-24-20(23)18-11-13-21(14-12-18)19(22)17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-10,18H,11-14H2,1H3 | COC(=O)C1CCN(C(=O)c2ccc(-c3ccccc3)cc2)CC1 |
InChI=1S/C18H20N2O3/c1-4-23-18(22)14-6-5-7-15(12-14)19-17(21)13-8-10-16(11-9-13)20(2)3/h5-12H,4H2,1-3H3,(H,19,21) | CCOC(=O)c1cccc(NC(=O)c2ccc(N(C)C)cc2)c1 |
InChI=1S/C17H21N3O3S/c1-20(2)15-7-5-14(6-8-15)17(21)19-12-11-13-3-9-16(10-4-13)24(18,22)23/h3-10H,11-12H2,1-2H3,(H,19,21)(H2,18,22,23) | CN(C)c1ccc(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc1 |
InChI=1S/C17H24N2O3/c1-4-22-17(21)14-6-5-11-19(12-14)16(20)13-7-9-15(10-8-13)18(2)3/h7-10,14H,4-6,11-12H2,1-3H3 | CCOC(=O)C1CCCN(C(=O)c2ccc(N(C)C)cc2)C1 |
InChI=1S/C18H19N3O3/c1-12(22)19-15-6-4-14(5-7-15)18(24)20-16-8-10-17(11-9-16)21(3)13(2)23/h4-11H,1-3H3,(H,19,22)(H,20,24) | CC(=O)Nc1ccc(C(=O)Nc2ccc(N(C)C(C)=O)cc2)cc1 |
InChI=1S/C13H17NO4/c1-9(8-17-3)14-13(16)11-4-6-12(7-5-11)18-10(2)15/h4-7,9H,8H2,1-3H3,(H,14,16) | COCC(C)NC(=O)c1ccc(OC(C)=O)cc1 |
InChI=1S/C17H21NO5/c1-3-22-17(21)14-5-4-10-18(11-14)16(20)13-6-8-15(9-7-13)23-12(2)19/h6-9,14H,3-5,10-11H2,1-2H3 | CCOC(=O)C1CCCN(C(=O)c2ccc(OC(C)=O)cc2)C1 |
InChI=1S/C16H19NO5/c1-11(18)22-14-5-3-12(4-6-14)15(19)17-9-7-13(8-10-17)16(20)21-2/h3-6,13H,7-10H2,1-2H3 | COC(=O)C1CCN(C(=O)c2ccc(OC(C)=O)cc2)CC1 |
InChI=1S/C15H12BrNO3/c1-10(18)20-12-8-6-11(7-9-12)15(19)17-14-5-3-2-4-13(14)16/h2-9H,1H3,(H,17,19) | CC(=O)Oc1ccc(C(=O)Nc2ccccc2Br)cc1 |
InChI=1S/C18H18N2O4/c1-12(21)20(3)15-10-8-14(9-11-15)19-18(23)16-6-4-5-7-17(16)24-13(2)22/h4-11H,1-3H3,(H,19,23) | CC(=O)Oc1ccccc1C(=O)Nc1ccc(N(C)C(C)=O)cc1 |
InChI=1S/C17H21NO5/c1-3-22-17(21)13-7-6-10-18(11-13)16(20)14-8-4-5-9-15(14)23-12(2)19/h4-5,8-9,13H,3,6-7,10-11H2,1-2H3 | CCOC(=O)C1CCCN(C(=O)c2ccccc2OC(C)=O)C1 |
InChI=1S/C16H19NO5/c1-11(18)22-14-6-4-3-5-13(14)15(19)17-9-7-12(8-10-17)16(20)21-2/h3-6,12H,7-10H2,1-2H3 | COC(=O)C1CCN(C(=O)c2ccccc2OC(C)=O)CC1 |
InChI=1S/C17H15NO5/c1-11(19)23-14-5-3-2-4-13(14)17(20)18-9-12-6-7-15-16(8-12)22-10-21-15/h2-8H,9-10H2,1H3,(H,18,20) | CC(=O)Oc1ccccc1C(=O)NCc1ccc2c(c1)OCO2 |
InChI=1S/C15H18N2O2/c1-10-9-13(17-19-10)16-14(18)11-5-7-12(8-6-11)15(2,3)4/h5-9H,1-4H3,(H,16,17,18) | Cc1cc(NC(=O)c2ccc(C(C)(C)C)cc2)no1 |
InChI=1S/C11H13Cl2NO2/c1-7(6-16-2)14-11(15)10-8(12)4-3-5-9(10)13/h3-5,7H,6H2,1-2H3,(H,14,15) | COCC(C)NC(=O)c1c(Cl)cccc1Cl |
InChI=1S/C17H15NO5/c1-2-21-17(20)12-4-3-5-13(8-12)18-16(19)11-6-7-14-15(9-11)23-10-22-14/h3-9H,2,10H2,1H3,(H,18,19) | CCOC(=O)c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1 |
InChI=1S/C14H18N2O4/c1-2-20-13(17)11-4-3-5-12(10-11)15-14(18)16-6-8-19-9-7-16/h3-5,10H,2,6-9H2,1H3,(H,15,18) | CCOC(=O)c1cccc(NC(=O)N2CCOCC2)c1 |
InChI=1S/C13H19N3O4S/c14-21(18,19)12-3-1-11(2-4-12)5-6-15-13(17)16-7-9-20-10-8-16/h1-4H,5-10H2,(H,15,17)(H2,14,18,19) | NS(=O)(=O)c1ccc(CCNC(=O)N2CCOCC2)cc1 |
InChI=1S/C14H19N3O3/c1-11(18)16(2)13-5-3-12(4-6-13)15-14(19)17-7-9-20-10-8-17/h3-6H,7-10H2,1-2H3,(H,15,19) | CC(=O)N(C)c1ccc(NC(=O)N2CCOCC2)cc1 |
InChI=1S/C13H22N2O4/c1-2-19-12(16)11-4-3-5-15(10-11)13(17)14-6-8-18-9-7-14/h11H,2-10H2,1H3 | CCOC(=O)C1CCCN(C(=O)N2CCOCC2)C1 |
InChI=1S/C18H20N2O3/c1-4-23-17-8-6-5-7-16(17)18(22)19-14-9-11-15(12-10-14)20(3)13(2)21/h5-12H,4H2,1-3H3,(H,19,22) | CCOc1ccccc1C(=O)Nc1ccc(N(C)C(C)=O)cc1 |
InChI=1S/C17H23NO4/c1-3-21-15-10-6-5-9-14(15)16(19)18-11-7-8-13(12-18)17(20)22-4-2/h5-6,9-10,13H,3-4,7-8,11-12H2,1-2H3 | CCOC(=O)C1CCCN(C(=O)c2ccccc2OCC)C1 |
InChI=1S/C17H17NO4/c1-2-20-14-6-4-3-5-13(14)17(19)18-10-12-7-8-15-16(9-12)22-11-21-15/h3-9H,2,10-11H2,1H3,(H,18,19) | CCOc1ccccc1C(=O)NCc1ccc2c(c1)OCO2 |
InChI=1S/C14H14ClN3O/c1-9-7-10(2)17-14(16-9)18-13(19)8-11-3-5-12(15)6-4-11/h3-7H,8H2,1-2H3,(H,16,17,18,19) | Cc1cc(C)nc(NC(=O)Cc2ccc(Cl)cc2)n1 |
InChI=1S/C12H11ClN2O2/c1-8-6-11(15-17-8)14-12(16)7-9-2-4-10(13)5-3-9/h2-6H,7H2,1H3,(H,14,15,16) | Cc1cc(NC(=O)Cc2ccc(Cl)cc2)no1 |
InChI=1S/C16H20ClNO3/c1-2-21-16(20)13-4-3-9-18(11-13)15(19)10-12-5-7-14(17)8-6-12/h5-8,13H,2-4,9-11H2,1H3 | CCOC(=O)C1CCCN(C(=O)Cc2ccc(Cl)cc2)C1 |
InChI=1S/C11H10BrN3OS/c1-7-14-15-11(17-7)13-10(16)6-8-2-4-9(12)5-3-8/h2-5H,6H2,1H3,(H,13,15,16) | Cc1nnc(NC(=O)Cc2ccc(Br)cc2)s1 |
InChI=1S/C12H16BrNO2/c1-9(8-16-2)14-12(15)7-10-3-5-11(13)6-4-10/h3-6,9H,7-8H2,1-2H3,(H,14,15) | COCC(C)NC(=O)Cc1ccc(Br)cc1 |
InChI=1S/C12H11BrN2O2/c1-8-6-11(15-17-8)14-12(16)7-9-2-4-10(13)5-3-9/h2-6H,7H2,1H3,(H,14,15,16) | Cc1cc(NC(=O)Cc2ccc(Br)cc2)no1 |
InChI=1S/C17H20N2O3S/c18-23(21,22)16-9-6-15(7-10-16)12-13-19-17(20)11-8-14-4-2-1-3-5-14/h1-7,9-10H,8,11-13H2,(H,19,20)(H2,18,21,22) | NS(=O)(=O)c1ccc(CCNC(=O)CCc2ccccc2)cc1 |
InChI=1S/C17H23NO3/c1-2-21-17(20)15-9-6-12-18(13-15)16(19)11-10-14-7-4-3-5-8-14/h3-5,7-8,15H,2,6,9-13H2,1H3 | CCOC(=O)C1CCCN(C(=O)CCc2ccccc2)C1 |
InChI=1S/C13H15N3OS/c1-3-11(10-7-5-4-6-8-10)12(17)14-13-16-15-9(2)18-13/h4-8,11H,3H2,1-2H3,(H,14,16,17) | CCC(C(=O)Nc1nnc(C)s1)c1ccccc1 |
InChI=1S/C17H23NO3/c1-3-15(13-7-5-4-6-8-13)16(19)18-11-9-14(10-12-18)17(20)21-2/h4-8,14-15H,3,9-12H2,1-2H3 | CCC(C(=O)N1CCC(C(=O)OC)CC1)c1ccccc1 |
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