inchi stringlengths 33 163 | smiles stringlengths 15 57 |
|---|---|
InChI=1S/C16H16N4O2/c21-15(13-5-1-3-7-17-13)19-9-11-20(12-10-19)16(22)14-6-2-4-8-18-14/h1-8H,9-12H2 | O=C(c1ccccn1)N1CCN(C(=O)c2ccccn2)CC1 |
InChI=1S/C17H15N3O2/c1-22-16-5-3-2-4-13(16)11-19-17(21)15-7-6-12-10-18-9-8-14(12)20-15/h2-10H,11H2,1H3,(H,19,21) | COc1ccccc1CNC(=O)c1ccc2cnccc2n1 |
InChI=1S/C10H12FN5O3/c11-5-7(18)4(1-17)19-10(5)16-3-15-6-8(12)13-2-14-9(6)16/h2-5,7,10,17-18H,1H2,(H2,12,13,14) | Nc1ncnc2c1ncn2C1OC(CO)C(O)C1F |
InChI=1S/C18H17NO3/c20-18(19-9-11-21-12-10-19)17-13-5-1-3-7-15(13)22-16-8-4-2-6-14(16)17/h1-8,17H,9-12H2 | O=C(C1c2ccccc2Oc2ccccc21)N1CCOCC1 |
InChI=1S/C10H17N5O2S/c1-13(2)18(16,17)15-8-6-14(7-9-15)10-11-4-3-5-12-10/h3-5H,6-9H2,1-2H3 | CN(C)S(=O)(=O)N1CCN(c2ncccn2)CC1 |
InChI=1S/C15H23NO4/c1-8-3-9(2)15(19)11(4-8)12-5-10(6-13(16)17)7-14(18)20-12/h8-12H,3-7H2,1-2H3,(H2,16,17) | CC1CC(C)C(=O)C(C2CC(CC(N)=O)CC(=O)O2)C1 |
InChI=1S/C14H18N2O2S/c1-8-9(2)19-12-11(8)13(17)16(14(18)15-12)10-6-4-3-5-7-10/h10H,3-7H2,1-2H3,(H,15,18) | Cc1sc2[nH]c(=O)n(C3CCCCC3)c(=O)c2c1C |
InChI=1S/C12H16N6O2S/c1-14-10-7-11(17-12(15-2)16-10)18-21(19,20)9-5-3-8(13)4-6-9/h3-7H,13H2,1-2H3,(H3,14,15,16,17,18) | CNc1cc(=NS(=O)(=O)c2ccc(N)cc2)[nH]c(NC)n1 |
InChI=1S/C21H22N2O2/c1-14(24)23-9-8-17-11-18(15-4-3-5-19(22)12-15)10-16-6-7-20(25-2)13-21(16)17/h3-7,10-13H,8-9,22H2,1-2H3,(H,23,24) | COc1ccc2cc(-c3cccc(N)c3)cc(CCNC(C)=O)c2c1 |
InChI=1S/C13H12N4O2S/c1-8-3-5-10(6-4-8)19-7-11-16-17-12(18)9(2)14-15-13(17)20-11/h3-6H,7H2,1-2H3 | Cc1ccc(OCc2nn3c(=O)c(C)nnc3s2)cc1 |
InChI=1S/C12H9ClN4O2S/c1-7-11(18)17-12(15-14-7)20-10(16-17)6-19-9-4-2-8(13)3-5-9/h2-5H,6H2,1H3 | Cc1nnc2sc(COc3ccc(Cl)cc3)nn2c1=O |
InChI=1S/C13H14ClN3O/c14-11-3-1-10(2-4-11)12-9-15-16-13(12)17-5-7-18-8-6-17/h1-4,9H,5-8H2,(H,15,16) | Clc1ccc(-c2c[nH]nc2N2CCOCC2)cc1 |
InChI=1S/C15H15NO3/c1-11(17)16-12-6-8-13(9-7-12)19-15-5-3-4-14(10-15)18-2/h3-10H,1-2H3,(H,16,17) | COc1cccc(Oc2ccc(NC(C)=O)cc2)c1 |
InChI=1S/C17H22N2O3/c1-12(10-19-8-7-18-17(19)20)14-5-6-15(21-2)16(9-14)22-11-13-3-4-13/h5-9,12-13H,3-4,10-11H2,1-2H3,(H,18,20) | COc1ccc(C(C)Cn2cc[nH]c2=O)cc1OCC1CC1 |
InChI=1S/C14H10ClN3O/c15-11-8-4-5-9-12(11)18-14(19)16-13(17-18)10-6-2-1-3-7-10/h1-9H,(H,16,17,19) | O=c1[nH]c(-c2ccccc2)nn1-c1ccccc1Cl |
InChI=1S/C11H12N2O6/c1-2-5-3-13(11(18)12-9(5)17)10-8(16)7(15)6(4-14)19-10/h1,3,6-8,10,14-16H,4H2,(H,12,17,18) | C#Cc1cn(C2OC(CO)C(O)C2O)c(=O)[nH]c1=O |
InChI=1S/C12H14N2O5/c1-2-3-7-5-14(12(18)13-11(7)17)10-4-8(16)9(6-15)19-10/h5,8-10,15-16H,4,6H2,1H3,(H,13,17,18) | CC#Cc1cn(C2CC(O)C(CO)O2)c(=O)[nH]c1=O |
InChI=1S/C12H15N3O4/c1-2-3-7-5-15(12(18)14-11(7)13)10-4-8(17)9(6-16)19-10/h5,8-10,16-17H,4,6H2,1H3,(H2,13,14,18) | CC#Cc1cn(C2CC(O)C(CO)O2)c(=O)nc1N |
InChI=1S/C16H17NO2/c1-11-5-4-6-12(2)15(11)17-16(18)13-7-9-14(19-3)10-8-13/h4-10H,1-3H3,(H,17,18) | COc1ccc(C(=O)Nc2c(C)cccc2C)cc1 |
InChI=1S/C16H14N2O/c1-11-4-3-5-12(2)15(11)18-16(19)14-8-6-13(10-17)7-9-14/h3-9H,1-2H3,(H,18,19) | Cc1cccc(C)c1NC(=O)c1ccc(C#N)cc1 |
InChI=1S/C10H13N5O3/c11-10-13-8-7(9(17)14-10)12-4-15(8)6-2-1-5(3-16)18-6/h4-6,16H,1-3H2,(H3,11,13,14,17) | Nc1nc2c(ncn2C2CCC(CO)O2)c(=O)[nH]1 |
InChI=1S/C17H18O5/c1-20-15-7-6-11(8-13(15)18)4-5-12-9-14(19)17(22-3)16(10-12)21-2/h4-10,18-19H,1-3H3 | COc1ccc(C=Cc2cc(O)c(OC)c(OC)c2)cc1O |
InChI=1S/C14H11N3S/c1-2-7-13-12(6-1)14(17-10-16-13)18-9-11-5-3-4-8-15-11/h1-8,10H,9H2 | c1ccc(CSc2ncnc3ccccc23)nc1 |
InChI=1S/C16H12N4S/c1-2-6-12-11(5-1)16(18-10-17-12)21-9-15-19-13-7-3-4-8-14(13)20-15/h1-8,10H,9H2,(H,19,20) | c1ccc2[nH]c(CSc3ncnc4ccccc34)nc2c1 |
InChI=1S/C10H12FN5O2/c11-6-1-5(2-17)18-10(6)16-4-15-7-8(12)13-3-14-9(7)16/h3-6,10,17H,1-2H2,(H2,12,13,14) | Nc1ncnc2c1ncn2C1OC(CO)CC1F |
InChI=1S/C19H16N2O3/c1-3-8-16-17(24-13(2)22)15-11-7-12-20-18(15)21(19(16)23)14-9-5-4-6-10-14/h3-7,9-12H,1,8H2,2H3 | C=CCc1c(OC(C)=O)c2cccnc2n(-c2ccccc2)c1=O |
InChI=1S/C13H16N4O2/c1-18-10-4-3-8(6-11(10)19-2)5-9-7-16-13(15)17-12(9)14/h3-4,6-7H,5H2,1-2H3,(H4,14,15,16,17) | COc1ccc(Cc2cnc(N)nc2N)cc1OC |
InChI=1S/C11H16N2O5/c1-2-6-4-13(11(17)12-10(6)16)9-3-7(15)8(5-14)18-9/h4,7-9,14-15H,2-3,5H2,1H3,(H,12,16,17) | CCc1cn(C2CC(O)C(CO)O2)c(=O)[nH]c1=O |
InChI=1S/C16H18O4/c1-19-14-8-12(7-13(17)10-14)4-3-11-5-6-15(18)16(9-11)20-2/h5-10,17-18H,3-4H2,1-2H3 | COc1cc(O)cc(CCc2ccc(O)c(OC)c2)c1 |
InChI=1S/C12H17N5O4/c1-16(2)10-7-11(14-4-13-10)17(5-15-7)12-9(20)8(19)6(3-18)21-12/h4-6,8-9,12,18-20H,3H2,1-2H3 | CN(C)c1ncnc2c1ncn2C1OC(CO)C(O)C1O |
InChI=1S/C13H17N3OS/c1-9-7-15-11(10(2)12(9)17-4)8-18-13-14-5-6-16(13)3/h5-7H,8H2,1-4H3 | COc1c(C)cnc(CSc2nccn2C)c1C |
InChI=1S/C19H17N3O2/c1-11-14-9-21-8-7-12(14)15(10-24-19(23)20-2)18-17(11)13-5-3-4-6-16(13)22-18/h3-9,22H,10H2,1-2H3,(H,20,23) | CNC(=O)OCc1c2ccncc2c(C)c2c1[nH]c1ccccc12 |
InChI=1S/C14H10N4O/c19-13-8-12(10-3-6-15-7-4-10)17-14(18-13)11-2-1-5-16-9-11/h1-9H,(H,17,18,19) | O=c1cc(-c2ccncc2)nc(-c2cccnc2)[nH]1 |
InChI=1S/C14H10N2O3S/c17-11-8-4-1-2-5-9(8)19-12-10(11)13(18)16-6-3-7-20-14(16)15-12/h1-2,4-5H,3,6-7H2 | O=c1c2ccccc2oc2nc3n(c(=O)c12)CCCS3 |
InChI=1S/C14H9ClN2O3S/c15-7-2-3-9-8(6-7)11(18)10-12(20-9)16-14-17(13(10)19)4-1-5-21-14/h2-3,6H,1,4-5H2 | O=c1c2cc(Cl)ccc2oc2nc3n(c(=O)c12)CCCS3 |
InChI=1S/C16H19FN2O2/c17-13-5-3-11(4-6-13)15(20)18-14-7-9-19(10-8-14)16(21)12-1-2-12/h3-6,12,14H,1-2,7-10H2,(H,18,20) | O=C(NC1CCN(C(=O)C2CC2)CC1)c1ccc(F)cc1 |
InChI=1S/C14H11N3O2/c15-13(19)10-2-1-3-11-12(10)17-14(16-11)8-4-6-9(18)7-5-8/h1-7,18H,(H2,15,19)(H,16,17) | NC(=O)c1cccc2[nH]c(-c3ccc(O)cc3)nc12 |
InChI=1S/C17H12ClN3O2/c18-13-5-3-12(4-6-13)17(22)21-14-7-8-16(20-10-14)23-15-2-1-9-19-11-15/h1-11H,(H,21,22) | O=C(Nc1ccc(Oc2cccnc2)nc1)c1ccc(Cl)cc1 |
InChI=1S/C15H18N2O2/c1-10(2)7-8-16-15(19)12-9-17-13-6-4-3-5-11(13)14(12)18/h3-6,9-10H,7-8H2,1-2H3,(H,16,19)(H,17,18) | CC(C)CCNC(=O)c1c[nH]c2ccccc2c1=O |
InChI=1S/C18H17N3O3/c1-2-24-13-5-6-16-14(8-13)17(22)15(11-20-16)18(23)21-10-12-4-3-7-19-9-12/h3-9,11H,2,10H2,1H3,(H,20,22)(H,21,23) | CCOc1ccc2[nH]cc(C(=O)NCc3cccnc3)c(=O)c2c1 |
InChI=1S/C17H13FN2O2/c18-14-8-4-7-12-15(14)19-10-13(16(12)21)17(22)20-9-11-5-2-1-3-6-11/h1-8,10H,9H2,(H,19,21)(H,20,22) | O=C(NCc1ccccc1)c1c[nH]c2c(F)cccc2c1=O |
InChI=1S/C18H24N2/c1-13(2)16-9-7-10-17(14(3)4)18(16)20-12-15-8-5-6-11-19-15/h5-11,13-14,20H,12H2,1-4H3 | CC(C)c1cccc(C(C)C)c1NCc1ccccn1 |
InChI=1S/C16H19NO2/c1-11-6-8-13(9-7-11)17-16(18)15-10-12-4-2-3-5-14(12)19-15/h2-5,10-11,13H,6-9H2,1H3,(H,17,18) | CC1CCC(NC(=O)c2cc3ccccc3o2)CC1 |
InChI=1S/C16H16N2O3/c1-20-12-4-5-14-13(9-12)11(10-18-14)6-7-17-16(19)15-3-2-8-21-15/h2-5,8-10,18H,6-7H2,1H3,(H,17,19) | COc1ccc2[nH]cc(CCNC(=O)c3ccco3)c2c1 |
InChI=1S/C16H20N2O3/c1-20-12-4-5-14-13(9-12)11(10-18-14)6-7-17-16(19)15-3-2-8-21-15/h4-5,9-10,15,18H,2-3,6-8H2,1H3,(H,17,19) | COc1ccc2[nH]cc(CCNC(=O)C3CCCO3)c2c1 |
InChI=1S/C18H14N4O/c1-23-16-6-4-13(5-7-16)15-10-20-18-17(11-21-22(18)12-15)14-3-2-8-19-9-14/h2-12H,1H3 | COc1ccc(-c2cnc3c(-c4cccnc4)cnn3c2)cc1 |
InChI=1S/C14H13N3O2/c1-2-19-14(18)13-12(16)10(8-15)9-17(13)11-6-4-3-5-7-11/h3-7,9H,2,16H2,1H3 | CCOC(=O)c1c(N)c(C#N)cn1-c1ccccc1 |
InChI=1S/C16H20N2O4S/c1-3-22-16(21)13-11-6-7-18(9(2)19)8-12(11)23-15(13)17-14(20)10-4-5-10/h10H,3-8H2,1-2H3,(H,17,20) | CCOC(=O)c1c(NC(=O)C2CC2)sc2c1CCN(C(C)=O)C2 |
InChI=1S/C15H10ClN3/c16-11-9-14(12-5-1-3-7-17-12)19-15(10-11)13-6-2-4-8-18-13/h1-10H | Clc1cc(-c2ccccn2)nc(-c2ccccn2)c1 |
InChI=1S/C13H9ClN4O/c14-10-4-2-1-3-8(10)13(19)17-11-5-6-15-12-9(11)7-16-18-12/h1-7H,(H2,15,16,17,18,19) | O=C(Nc1ccnc2[nH]ncc12)c1ccccc1Cl |
InChI=1S/C16H16N4O2/c1-10(2)22-14-6-4-3-5-11(14)16(21)19-13-7-8-17-15-12(13)9-18-20-15/h3-10H,1-2H3,(H2,17,18,19,20,21) | CC(C)Oc1ccccc1C(=O)Nc1ccnc2[nH]ncc12 |
InChI=1S/C16H15N5O/c1-21-19-16(18-20-21)17-15(22)14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11,14H,1H3,(H,17,19,22) | Cn1nnc(NC(=O)C(c2ccccc2)c2ccccc2)n1 |
InChI=1S/C9H10BrF3N2O2/c1-3-17-6(16)4-15-5(2)7(10)8(14-15)9(11,12)13/h3-4H2,1-2H3 | CCOC(=O)Cn1nc(C(F)(F)F)c(Br)c1C |
InChI=1S/C11H8Cl2N2O2S/c12-7-1-2-9(8(13)5-7)17-6-10(16)15-11-14-3-4-18-11/h1-5H,6H2,(H,14,15,16) | O=C(COc1ccc(Cl)cc1Cl)Nc1nccs1 |
InChI=1S/C14H18O5/c1-16-14-10(15)7-11-12(19-14)8-17-13(18-11)9-5-3-2-4-6-9/h2-6,10-15H,7-8H2,1H3 | COC1OC2COC(c3ccccc3)OC2CC1O |
InChI=1S/C11H21N7O/c1-6(2)13-9-15-10(14-7(3)4)17-11(16-9)18(5)8(12)19/h6-7H,1-5H3,(H2,12,19)(H2,13,14,15,16,17) | CC(C)Nc1nc(NC(C)C)nc(N(C)C(N)=O)n1 |
InChI=1S/C15H15F3N2O3/c1-3-23-13(21)11-8(2)19-14(22)20-12(11)9-6-4-5-7-10(9)15(16,17)18/h4-7,12H,3H2,1-2H3,(H2,19,20,22) | CCOC(=O)C1=C(C)NC(=O)NC1c1ccccc1C(F)(F)F |
InChI=1S/C18H20N2O/c1-13-12-17(19-15-8-4-3-5-9-15)16-10-6-7-11-18(16)20(13)14(2)21/h3-11,13,17,19H,12H2,1-2H3 | CC(=O)N1c2ccccc2C(Nc2ccccc2)CC1C |
InChI=1S/C17H15NO3/c19-17(13-7-8-15-16(10-13)21-11-20-15)18-9-3-5-12-4-1-2-6-14(12)18/h1-2,4,6-8,10H,3,5,9,11H2 | O=C(c1ccc2c(c1)OCO2)N1CCCc2ccccc21 |
InChI=1S/C16H28N2O2/c1-6-14(19)17-13-10-12(9-8-11(13)3)16(4,5)18-15(20)7-2/h8,12-13H,6-7,9-10H2,1-5H3,(H,17,19)(H,18,20) | CCC(=O)NC1CC(C(C)(C)NC(=O)CC)CC=C1C |
InChI=1S/C13H9ClN2O2/c14-7-1-4-12-10(5-7)16-13(18-12)9-3-2-8(15)6-11(9)17/h1-6,17H,15H2 | Nc1ccc(-c2nc3cc(Cl)ccc3o2)c(O)c1 |
InChI=1S/C13H10Cl2N2O/c14-11-5-4-9(7-12(11)15)13(18)17-8-10-3-1-2-6-16-10/h1-7H,8H2,(H,17,18) | O=C(NCc1ccccn1)c1ccc(Cl)c(Cl)c1 |
InChI=1S/C14H14N2O3S/c15-12(17)11-8-4-1-2-6-10(8)20-14(11)16-13(18)9-5-3-7-19-9/h3,5,7H,1-2,4,6H2,(H2,15,17)(H,16,18) | NC(=O)c1c(NC(=O)c2ccco2)sc2c1CCCC2 |
InChI=1S/C17H22N2O2S/c18-15(20)14-11-3-1-2-4-13(11)22-17(14)19-16(21)12-8-9-5-6-10(12)7-9/h9-10,12H,1-8H2,(H2,18,20)(H,19,21) | NC(=O)c1c(NC(=O)C2CC3CCC2C3)sc2c1CCCC2 |
InChI=1S/C20H20N4O2/c1-13-6-4-8-15(10-13)21-19(25)17-12-18(24(3)23-17)20(26)22-16-9-5-7-14(2)11-16/h4-12H,1-3H3,(H,21,25)(H,22,26) | Cc1cccc(NC(=O)c2cc(C(=O)Nc3cccc(C)c3)n(C)n2)c1 |
InChI=1S/C20H20N4O2/c1-24-18(20(26)22-14-16-10-6-3-7-11-16)12-17(23-24)19(25)21-13-15-8-4-2-5-9-15/h2-12H,13-14H2,1H3,(H,21,25)(H,22,26) | Cn1nc(C(=O)NCc2ccccc2)cc1C(=O)NCc1ccccc1 |
InChI=1S/C16H14N4O/c1-12(21)15-16(17-13-8-4-2-5-9-13)20(19-18-15)14-10-6-3-7-11-14/h2-11,17H,1H3 | CC(=O)c1nnn(-c2ccccc2)c1Nc1ccccc1 |
InChI=1S/C15H11F3N4O2/c1-24-9-4-2-8(3-5-9)10-6-12(15(16,17)18)22-13(20-10)7-11(21-22)14(19)23/h2-7H,1H3,(H2,19,23) | COc1ccc(-c2cc(C(F)(F)F)n3nc(C(N)=O)cc3n2)cc1 |
InChI=1S/C17H12N2O3S/c1-22-14-8-10(6-7-13(14)20)9-15-16(21)19-12-5-3-2-4-11(12)18-17(19)23-15/h2-9,20H,1H3 | COc1cc(C=c2sc3nc4ccccc4n3c2=O)ccc1O |
InChI=1S/C16H23N7O2/c1-12-11-13(2)23(20-12)16-18-14(21-3-7-24-8-4-21)17-15(19-16)22-5-9-25-10-6-22/h11H,3-10H2,1-2H3 | Cc1cc(C)n(-c2nc(N3CCOCC3)nc(N3CCOCC3)n2)n1 |
InChI=1S/C16H16N6O2/c1-12-7-5-6-10-14(12)24-11-15(23)19-22-16(18-20-21-22)17-13-8-3-2-4-9-13/h2-10H,11H2,1H3,(H,19,23)(H,17,18,21) | Cc1ccccc1OCC(=O)Nn1nnnc1Nc1ccccc1 |
InChI=1S/C10H10BrN3O3/c1-3-17-10(16)6-4-12-8-7(11)9(15)13-14(8)5(6)2/h4H,3H2,1-2H3,(H,13,15) | CCOC(=O)c1cnc2c(Br)c(=O)[nH]n2c1C |
InChI=1S/C13H10BrN3O/c1-8-7-10(9-5-3-2-4-6-9)17-12(15-8)11(14)13(18)16-17/h2-7H,1H3,(H,16,18) | Cc1cc(-c2ccccc2)n2[nH]c(=O)c(Br)c2n1 |
InChI=1S/C14H15NO3S2/c1-4-9-8(2)20-13(11(9)14(17)18-3)15-12(16)10-6-5-7-19-10/h5-7H,4H2,1-3H3,(H,15,16) | CCc1c(C)sc(NC(=O)c2cccs2)c1C(=O)OC |
InChI=1S/C15H16N2O3S/c1-4-11-9(2)21-14(12(11)15(19)20-3)17-13(18)10-5-7-16-8-6-10/h5-8H,4H2,1-3H3,(H,17,18) | CCc1c(C)sc(NC(=O)c2ccncc2)c1C(=O)OC |
InChI=1S/C18H11N3O/c19-10-15-13(12-5-2-1-3-6-12)9-14(16(11-20)18(15)21)17-7-4-8-22-17/h1-9H,21H2 | N#Cc1c(-c2ccccc2)cc(-c2ccco2)c(C#N)c1N |
InChI=1S/C17H15N3O/c1-11(21)19-17-15(10-18)14(12-5-3-2-4-6-12)9-16(20-17)13-7-8-13/h2-6,9,13H,7-8H2,1H3,(H,19,20,21) | CC(=O)Nc1nc(C2CC2)cc(-c2ccccc2)c1C#N |
InChI=1S/C12H13Cl2NO3/c13-9-1-2-11(10(14)7-9)18-8-12(16)15-3-5-17-6-4-15/h1-2,7H,3-6,8H2 | O=C(COc1ccc(Cl)cc1Cl)N1CCOCC1 |
InChI=1S/C15H21NO6/c1-9(18)16-12-14(20)13(19)11(7-17)22-15(12)21-8-10-5-3-2-4-6-10/h2-6,11-15,17,19-20H,7-8H2,1H3,(H,16,18) | CC(=O)NC1C(OCc2ccccc2)OC(CO)C(O)C1O |
InChI=1S/C19H24O6/c1-4-24-17(21)15-13(20)11-19(3,23)16(18(22)25-5-2)14(15)12-9-7-6-8-10-12/h6-10,14-16,23H,4-5,11H2,1-3H3 | CCOC(=O)C1C(=O)CC(C)(O)C(C(=O)OCC)C1c1ccccc1 |
InChI=1S/C22H20N2O2/c25-21(23-15-17-9-3-1-4-10-17)19-13-7-8-14-20(19)22(26)24-16-18-11-5-2-6-12-18/h1-14H,15-16H2,(H,23,25)(H,24,26) | O=C(NCc1ccccc1)c1ccccc1C(=O)NCc1ccccc1 |
InChI=1S/C14H15NO2S/c1-12-7-9-14(10-8-12)18(16,17)15-11-13-5-3-2-4-6-13/h2-10,15H,11H2,1H3 | Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1 |
InChI=1S/C20H16N6/c1-13-17-19(25(23-13)15-9-5-3-6-10-15)22-20-18(21-17)14(2)24-26(20)16-11-7-4-8-12-16/h3-12H,1-2H3 | Cc1nn(-c2ccccc2)c2nc3c(nc12)c(C)nn3-c1ccccc1 |
InChI=1S/C15H14FNO2/c1-11-7-8-12(9-14(11)16)17-15(18)10-19-13-5-3-2-4-6-13/h2-9H,10H2,1H3,(H,17,18) | Cc1ccc(NC(=O)COc2ccccc2)cc1F |
InChI=1S/C12H18N2O3S/c1-9(15)13-10-5-7-11(8-6-10)18(16,17)14-12(2,3)4/h5-8,14H,1-4H3,(H,13,15) | CC(=O)Nc1ccc(S(=O)(=O)NC(C)(C)C)cc1 |
InChI=1S/C15H16N2O4S/c1-11(18)16-12-7-9-13(10-8-12)22(19,20)17-14-5-3-4-6-15(14)21-2/h3-10,17H,1-2H3,(H,16,18) | COc1ccccc1NS(=O)(=O)c1ccc(NC(C)=O)cc1 |
InChI=1S/C15H16N2O3S/c1-12(18)17-14-7-9-15(10-8-14)21(19,20)16-11-13-5-3-2-4-6-13/h2-10,16H,11H2,1H3,(H,17,18) | CC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1 |
InChI=1S/C14H20N2O3S/c1-11(17)15-12-7-9-14(10-8-12)20(18,19)16-13-5-3-2-4-6-13/h7-10,13,16H,2-6H2,1H3,(H,15,17) | CC(=O)Nc1ccc(S(=O)(=O)NC2CCCCC2)cc1 |
InChI=1S/C16H16N2O3/c1-11-3-2-4-14(9-11)21-10-15(19)18-13-7-5-12(6-8-13)16(17)20/h2-9H,10H2,1H3,(H2,17,20)(H,18,19) | Cc1cccc(OCC(=O)Nc2ccc(C(N)=O)cc2)c1 |
InChI=1S/C16H16N2O3S/c17-22(20,21)13-8-6-12(7-9-13)18-16(19)15-10-14(15)11-4-2-1-3-5-11/h1-9,14-15H,10H2,(H,18,19)(H2,17,20,21) | NS(=O)(=O)c1ccc(NC(=O)C2CC2c2ccccc2)cc1 |
InChI=1S/C20H18FN3O/c21-16-8-6-14(7-9-16)12-24-13-17(11-22-24)23-20(25)19-10-18(19)15-4-2-1-3-5-15/h1-9,11,13,18-19H,10,12H2,(H,23,25) | O=C(Nc1cnn(Cc2ccc(F)cc2)c1)C1CC1c1ccccc1 |
InChI=1S/C14H11N3OS2/c18-12(10-7-19-11-4-2-1-3-9(10)11)15-14-17-16-13(20-14)8-5-6-8/h1-4,7-8H,5-6H2,(H,15,17,18) | O=C(Nc1nnc(C2CC2)s1)c1csc2ccccc12 |
InChI=1S/C16H10O4/c17-15-11-7-3-1-5-9(11)13(19-15)14-10-6-2-4-8-12(10)16(18)20-14/h1-8,13-14H | O=C1OC(C2OC(=O)c3ccccc32)c2ccccc21 |
InChI=1S/C16H16N2O2/c1-11-3-7-15(8-4-11)18-16(20)13-5-9-14(10-6-13)17-12(2)19/h3-10H,1-2H3,(H,17,19)(H,18,20) | CC(=O)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1 |
InChI=1S/C15H13BrN2O2/c1-10(19)17-13-7-5-11(6-8-13)15(20)18-14-4-2-3-12(16)9-14/h2-9H,1H3,(H,17,19)(H,18,20) | CC(=O)Nc1ccc(C(=O)Nc2cccc(Br)c2)cc1 |
InChI=1S/C15H12Cl2N2O2/c1-9(20)18-14-6-5-10(7-13(14)17)15(21)19-12-4-2-3-11(16)8-12/h2-8H,1H3,(H,18,20)(H,19,21) | CC(=O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cc1Cl |
InChI=1S/C13H17ClN2O2/c1-4-16(5-2)13(18)10-6-7-12(11(14)8-10)15-9(3)17/h6-8H,4-5H2,1-3H3,(H,15,17) | CCN(CC)C(=O)c1ccc(NC(C)=O)c(Cl)c1 |
InChI=1S/C15H14N2O2/c1-11(18)16-14-9-7-12(8-10-14)15(19)17-13-5-3-2-4-6-13/h2-10H,1H3,(H,16,18)(H,17,19) | CC(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1 |
InChI=1S/C15H13ClN2O2/c1-10(19)17-13-7-5-11(6-8-13)15(20)18-14-4-2-3-12(16)9-14/h2-9H,1H3,(H,17,19)(H,18,20) | CC(=O)Nc1ccc(C(=O)Nc2cccc(Cl)c2)cc1 |
InChI=1S/C15H12Cl2N2O2/c1-9(20)18-12-5-2-10(3-6-12)15(21)19-14-8-11(16)4-7-13(14)17/h2-8H,1H3,(H,18,20)(H,19,21) | CC(=O)Nc1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1 |
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