 | | 8RP | | Name: | 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)ethan-1-one | | Formula: | C13 H17 N O3 | | SMILES: | N2(C(C)=O)CCc1cc(c(cc1C2)OC)OC | | InChi: | InChI=1S/C13H17NO3/c1-9(15)14-5-4-10-6-12(16-2)13(17-3)7-11(10)8-14/h6-7H,4-5,8H2,1-3H3 | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)ethan-1-one |
|
 | | 8RS | | Name: | 1-(4-phenylpiperazin-1-yl)ethan-1-one | | Formula: | C12 H16 N2 O | | SMILES: | N1(C(C)=O)CCN(CC1)c2ccccc2 | | InChi: | InChI=1S/C12H16N2O/c1-11(15)13-7-9-14(10-8-13)12-5-3-2-4-6-12/h2-6H,7-10H2,1H3 | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 1-(4-phenylpiperazin-1-yl)ethan-1-one |
|
 | | 8RV | | Name: | N-(1-benzylpiperidin-4-yl)acetamide | | Formula: | C14 H20 N2 O | | SMILES: | N(C(C)=O)C1CCN(CC1)Cc2ccccc2 | | InChi: | InChI=1S/C14H20N2O/c1-12(17)15-14-7-9-16(10-8-14)11-13-5-3-2-4-6-13/h2-6,14H,7-11H2,1H3,(H,15,17) | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | N-(1-benzylpiperidin-4-yl)acetamide |
|
 | | 8RY | | Name: | N-methylpyrimidine-2-carboxamide | | Formula: | C6 H7 N3 O | | SMILES: | N(C)C(c1ncccn1)=O | | InChi: | InChI=1S/C6H7N3O/c1-7-6(10)5-8-3-2-4-9-5/h2-4H,1H3,(H,7,10) | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | N-methylpyrimidine-2-carboxamide |
|
 | | 8S1 | | Name: | 5-amino-1-(2-chlorophenyl)-1H-pyrazole-4-carbonitrile | | Formula: | C10 H7 Cl N4 | | SMILES: | n1cc(c(N)n1c2ccccc2Cl)C#N | | InChi: | InChI=1S/C10H7ClN4/c11-8-3-1-2-4-9(8)15-10(13)7(5-12)6-14-15/h1-4,6H,13H2 | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 5-amino-1-(2-chlorophenyl)-1H-pyrazole-4-carbonitrile |
|
 | | 8S4 | | Name: | 1-[(4-methoxyphenyl)methyl]-1H-tetrazole | | Formula: | C9 H10 N4 O | | SMILES: | n2(Cc1ccc(OC)cc1)cnnn2 | | InChi: | InChI=1S/C9H10N4O/c1-14-9-4-2-8(3-5-9)6-13-7-10-11-12-13/h2-5,7H,6H2,1H3 | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 1-[(4-methoxyphenyl)methyl]-1H-tetrazole |
|
 | | 8S7 | | Name: | N-(3-methyl-1,2-oxazol-5-yl)cyclopropanecarboxamide | | Formula: | C8 H10 N2 O2 | | SMILES: | N(c1cc(C)no1)C(C2CC2)=O | | InChi: | InChI=1S/C8H10N2O2/c1-5-4-7(12-10-5)9-8(11)6-2-3-6/h4,6H,2-3H2,1H3,(H,9,11) | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | N-(3-methyl-1,2-oxazol-5-yl)cyclopropanecarboxamide |
|
 | | 8SA | | Name: | 5-methyl-N-[(thiophen-2-yl)methyl]-1,2-oxazol-3-amine | | Formula: | C9 H10 N2 O S | | SMILES: | N(c1noc(C)c1)Cc2cccs2 | | InChi: | InChI=1S/C9H10N2OS/c1-7-5-9(11-12-7)10-6-8-3-2-4-13-8/h2-5H,6H2,1H3,(H,10,11) | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 5-methyl-N-[(thiophen-2-yl)methyl]-1,2-oxazol-3-amine |
|
 | | 8SD | | Name: | 5-hydroxy-1,3-dihydro-2H-indol-2-one | | Formula: | C8 H7 N O2 | | SMILES: | N1C(Cc2cc(ccc12)O)=O | | InChi: | InChI=1S/C8H7NO2/c10-6-1-2-7-5(3-6)4-8(11)9-7/h1-3,10H,4H2,(H,9,11) | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 5-hydroxy-1,3-dihydro-2H-indol-2-one |
|
 | | 8SG | | Name: | N-(3-methyl-1,2-oxazol-5-yl)furan-2-carboxamide | | Formula: | C9 H8 N2 O3 | | SMILES: | N(C(=O)c1ccco1)c2cc(C)no2 | | InChi: | InChI=1S/C9H8N2O3/c1-6-5-8(14-11-6)10-9(12)7-3-2-4-13-7/h2-5H,1H3,(H,10,12) | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | N-(3-methyl-1,2-oxazol-5-yl)furan-2-carboxamide |
|
 | | 8SJ | | Name: | (4-nitrophenyl)methyl carbamimidothioate | | Formula: | C8 H9 N3 O2 S | | SMILES: | [N+]([O-])(=O)c1ccc(cc1)CSC(=[N@H])N | | InChi: | InChI=1S/C8H9N3O2S/c9-8(10)14-5-6-1-3-7(4-2-6)11(12)13/h1-4H,5H2,(H3,9,10) | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | (4-nitrophenyl)methyl carbamimidothioate |
|
 | | 8SM | | Name: | 2-[1-methyl-3-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]pyridine | | Formula: | C13 H12 N4 | | SMILES: | n2(cc(c1ccccn1)c(n2)n3cccc3)C | | InChi: | InChI=1S/C13H12N4/c1-16-10-11(12-6-2-3-7-14-12)13(15-16)17-8-4-5-9-17/h2-10H,1H3 | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 2-[1-methyl-3-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]pyridine |
|
 | | 8SS | | Name: | 4-(4-bromophenyl)-1H-pyrazol-3-amine | | Formula: | C9 H8 Br N3 | | SMILES: | n2cc(c1ccc(cc1)Br)c(N)n2 | | InChi: | InChI=1S/C9H8BrN3/c10-7-3-1-6(2-4-7)8-5-12-13-9(8)11/h1-5H,(H3,11,12,13) | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 4-(4-bromophenyl)-1H-pyrazol-3-amine |
|
 | | 8SV | | Name: | 1,3-dimethyl-5-(methylamino)-6-nitro-1,3-dihydro-2H-benzimidazol-2-one | | Formula: | C10 H12 N4 O3 | | SMILES: | N(c2c(cc1N(C(=O)N(c1c2)C)C)[N+]([O-])=O)C | | InChi: | InChI=1S/C10H12N4O3/c1-11-6-4-8-9(5-7(6)14(16)17)13(3)10(15)12(8)2/h4-5,11H,1-3H3 | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 1,3-dimethyl-5-(methylamino)-6-nitro-1,3-dihydro-2H-benzimidazol-2-one |
|
 | | 8SY | | Name: | 6-amino-1-methyl-3,4-dihydroquinolin-2(1H)-one | | Formula: | C10 H12 N2 O | | SMILES: | N1(C(CCc2cc(ccc12)N)=O)C | | InChi: | InChI=1S/C10H12N2O/c1-12-9-4-3-8(11)6-7(9)2-5-10(12)13/h3-4,6H,2,5,11H2,1H3 | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 6-amino-1-methyl-3,4-dihydroquinolin-2(1H)-one |
|
 | | 8T1 | | Name: | 6-amino-1-methylquinolin-2(1H)-one | | Formula: | C10 H10 N2 O | | SMILES: | N1(C)C(=O)C=Cc2c1ccc(c2)N | | InChi: | InChI=1S/C10H10N2O/c1-12-9-4-3-8(11)6-7(9)2-5-10(12)13/h2-6H,11H2,1H3 | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 6-amino-1-methylquinolin-2(1H)-one |
|
 | | 8T4 | | Name: | 1-methyl-4-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole | | Formula: | C14 H13 N3 | | SMILES: | Cn3c(n1cccc1)c(c2ccccc2)cn3 | | InChi: | InChI=1S/C14H13N3/c1-16-14(17-9-5-6-10-17)13(11-15-16)12-7-3-2-4-8-12/h2-11H,1H3 | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 1-methyl-4-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole |
|
 | | 8T7 | | Name: | 1-methyl-4-phenyl-3-(trifluoromethyl)-1H-pyrazol-5-amine | | Formula: | C11 H10 F3 N3 | | SMILES: | n2(C)nc(C(F)(F)F)c(c1ccccc1)c2N | | InChi: | InChI=1S/C11H10F3N3/c1-17-10(15)8(7-5-3-2-4-6-7)9(16-17)11(12,13)14/h2-6H,15H2,1H3 | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 1-methyl-4-phenyl-3-(trifluoromethyl)-1H-pyrazol-5-amine |
|
 | | 8TA | | Name: | 2-[5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]pyridine | | Formula: | C12 H10 N4 | | SMILES: | n1ccccc1c2cnnc2n3cccc3 | | InChi: | InChI=1S/C12H10N4/c1-2-6-13-11(5-1)10-9-14-15-12(10)16-7-3-4-8-16/h1-9H,(H,14,15) | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 2-[5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]pyridine |
|
 | | 8TD | | Name: | 5-amino-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one | | Formula: | C9 H11 N3 O | | SMILES: | N1(C)C(=O)N(c2cc(N)ccc12)C | | InChi: | InChI=1S/C9H11N3O/c1-11-7-4-3-6(10)5-8(7)12(2)9(11)13/h3-5H,10H2,1-2H3 | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 5-amino-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one |
|
 | | 8TG | | Name: | 7-bromo-1-methyl-6-nitroquinolin-2(1H)-one | | Formula: | C10 H7 Br N2 O3 | | SMILES: | N1(C)C(=O)C=Cc2c1cc(c(c2)[N+]([O-])=O)Br | | InChi: | InChI=1S/C10H7BrN2O3/c1-12-8-5-7(11)9(13(15)16)4-6(8)2-3-10(12)14/h2-5H,1H3 | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 7-bromo-1-methyl-6-nitroquinolin-2(1H)-one |
|
 | | 8TJ | | Name: | N-methylthieno[2,3-b]pyridine-2-carboxamide | | Formula: | C9 H8 N2 O S | | SMILES: | N(C(=O)c2cc1c(nccc1)s2)C | | InChi: | InChI=1S/C9H8N2OS/c1-10-8(12)7-5-6-3-2-4-11-9(6)13-7/h2-5H,1H3,(H,10,12) | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | N-methylthieno[2,3-b]pyridine-2-carboxamide |
|
 | | 8TP | | Name: | N-[2-(phenylamino)ethyl]acetamide | | Formula: | C10 H14 N2 O | | SMILES: | N(C(C)=O)CCNc1ccccc1 | | InChi: | InChI=1S/C10H14N2O/c1-9(13)11-7-8-12-10-5-3-2-4-6-10/h2-6,12H,7-8H2,1H3,(H,11,13) | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | N-[2-(phenylamino)ethyl]acetamide |
|
 | | 8TS | | Name: | 6-(4-acetylpiperazin-1-yl)pyridine-3-carbonitrile | | Formula: | C12 H14 N4 O | | SMILES: | N1(CCN(CC1)c2ccc(C#N)cn2)C(C)=O | | InChi: | InChI=1S/C12H14N4O/c1-10(17)15-4-6-16(7-5-15)12-3-2-11(8-13)9-14-12/h2-3,9H,4-7H2,1H3 | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 6-(4-acetylpiperazin-1-yl)pyridine-3-carbonitrile |
|
 | | 8TV | | Name: | 1-[4-(pyridin-4-yl)piperazin-1-yl]ethan-1-one | | Formula: | C11 H15 N3 O | | SMILES: | N1(C(C)=O)CCN(CC1)c2ccncc2 | | InChi: | InChI=1S/C11H15N3O/c1-10(15)13-6-8-14(9-7-13)11-2-4-12-5-3-11/h2-5H,6-9H2,1H3 | | Definition date: | 2017-03-03 | | Last modified: | 2017-03-10 | | Release date: | 2017-03-15 | | Identifier: | 1-[4-(pyridin-4-yl)piperazin-1-yl]ethan-1-one |
|
