 | | NTW | | Name: | 2-[4-(3-methyl-6-oxidanylidene-1,7-dihydropyrazolo[3,4-b]pyridin-4-yl)cyclohexyl]ethanenitrile | | Formula: | C15 H18 N4 O | | SMILES: | Cc1n[nH]c2NC(=O)C=C([CH]3CC[CH](CC3)CC#N)c12 | | InChi: | InChI=1S/C15H18N4O/c1-9-14-12(8-13(20)17-15(14)19-18-9)11-4-2-10(3-5-11)6-7-16/h8,10-11H,2-6H2,1H3,(H2,17,18,19,20)/t10-,11- | | Definition date: | 2019-12-13 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | 2-[4-(3-methyl-6-oxidanylidene-1,7-dihydropyrazolo[3,4-b]pyridin-4-yl)cyclohexyl]ethanenitrile |
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 | | T9S | | Name: | ethyl 1,3-dihydro-2H-pyrrolo[3,4-c]pyridine-2-carboxylate | | Formula: | C10 H12 N2 O2 | | SMILES: | c21CN(Cc1cncc2)C(=O)OCC | | InChi: | InChI=1S/C10H12N2O2/c1-2-14-10(13)12-6-8-3-4-11-5-9(8)7-12/h3-5H,2,6-7H2,1H3 | | Definition date: | 2020-03-18 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | ethyl 1,3-dihydro-2H-pyrrolo[3,4-c]pyridine-2-carboxylate |
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 | | T9V | | Name: | N-(4-methoxyphenyl)acetamide | | Formula: | C9 H11 N O2 | | SMILES: | c1cc(ccc1OC)NC(=O)C | | InChi: | InChI=1S/C9H11NO2/c1-7(11)10-8-3-5-9(12-2)6-4-8/h3-6H,1-2H3,(H,10,11) | | Definition date: | 2020-03-18 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | N-(4-methoxyphenyl)acetamide |
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 | | T9Y | | Name: | ethyl 5-(trifluoromethyl)-1H-pyrazole-4-carboxylate | | Formula: | C7 H7 F3 N2 O2 | | SMILES: | c1c(c(C(F)(F)F)nn1)C(OCC)=O | | InChi: | InChI=1S/C7H7F3N2O2/c1-2-14-6(13)4-3-11-12-5(4)7(8,9)10/h3H,2H2,1H3,(H,11,12) | | Definition date: | 2020-03-18 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | ethyl 5-(trifluoromethyl)-1H-pyrazole-4-carboxylate |
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 | | TJ1 | | Name: | 3-(propan-2-yl)-1,2,4-oxadiazol-5(4H)-one | | Formula: | C5 H8 N2 O2 | | SMILES: | C1(=O)NC(=NO1)C(C)C | | InChi: | InChI=1S/C5H8N2O2/c1-3(2)4-6-5(8)9-7-4/h3H,1-2H3,(H,6,7,8) | | Definition date: | 2020-03-20 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | 3-(propan-2-yl)-1,2,4-oxadiazol-5(4H)-one |
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 | | SWP | | Name: | methyl ((10R,14S)-14-(4-(3-chloro-2,6-difluorophenyl)-6-oxo-3,6-dihydro- 1(2h)-pyridinyl)-10-methyl-9-oxo-8,16-diazatricyclo[13.3.1.0~2,7~]nonadeca- 1(19),2,4,6,15,17-hexaen-5-yl)carbamate | | Formula: | C31 H29 Cl F2 N4 O4 | | SMILES: | COC(=O)Nc1ccc2c(NC(=O)[CH](C)CCC[CH](N3CCC(=CC3=O)c4c(F)ccc(Cl)c4F)c5cc2ccn5)c1 | | InChi: | InChI=1S/C31H29ClF2N4O4/c1-17-4-3-5-26(38-13-11-19(15-27(38)39)28-23(33)9-8-22(32)29(28)34)25-14-18(10-12-35-25)21-7-6-20(36-31(41)42-2)16-24(21)37-30(17)40/h6-10,12,14-17,26H,3-5,11,13H2,1-2H3,(H,36,41)(H,37,40)/t17-,26+/m1/s1 | | Definition date: | 2020-03-12 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | methyl ~{N}-[(10~{R},14~{S})-14-[4-[3-chloranyl-2,6-bis(fluoranyl)phenyl]-6-oxidanylidene-2,3-dihydropyridin-1-yl]-10-methyl-9-oxidanylidene-8,16-diazatricyclo[13.3.1.0^{2,7}]nonadeca-1(18),2,4,6,15(19),16-hexaen-5-yl]carbamate |
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 | | UKV | | Name: | (5Z)-5-[(3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one | | Formula: | C11 H9 N O2 S2 | | SMILES: | COc2cccc([C@H]=C1C(NC(S1)=S)=O)c2 | | InChi: | InChI=1S/C11H9NO2S2/c1-14-8-4-2-3-7(5-8)6-9-10(13)12-11(15)16-9/h2-6H,1H3,(H,12,13,15)/b9-6- | | Definition date: | 2020-05-20 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | (5Z)-5-[(3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
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 | | UL1 | | Name: | (5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one | | Formula: | C12 H11 N O3 S2 | | SMILES: | COc2ccc([C@H]=C1C(=O)NC(=S)S1)cc2OC | | InChi: | InChI=1S/C12H11NO3S2/c1-15-8-4-3-7(5-9(8)16-2)6-10-11(14)13-12(17)18-10/h3-6H,1-2H3,(H,13,14,17)/b10-6- | | Definition date: | 2020-05-20 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | (5Z)-5-[(3,4-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
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 | | UPD | | Name: | 1-acetyl-N-(6-methoxypyridin-3-yl)piperidine-4-carboxamide | | Formula: | C14 H19 N3 O3 | | SMILES: | N(c1cnc(cc1)OC)C(C2CCN(C(C)=O)CC2)=O | | InChi: | InChI=1S/C14H19N3O3/c1-10(18)17-7-5-11(6-8-17)14(19)16-12-3-4-13(20-2)15-9-12/h3-4,9,11H,5-8H2,1-2H3,(H,16,19) | | Definition date: | 2020-05-26 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | 1-acetyl-N-(6-methoxypyridin-3-yl)piperidine-4-carboxamide |
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 | | UPJ | | Name: | 1-acetyl-N-methyl-N-phenylpiperidine-4-carboxamide | | Formula: | C15 H20 N2 O2 | | SMILES: | N(c1ccccc1)(C)C(C2CCN(C(C)=O)CC2)=O | | InChi: | InChI=1S/C15H20N2O2/c1-12(18)17-10-8-13(9-11-17)15(19)16(2)14-6-4-3-5-7-14/h3-7,13H,8-11H2,1-2H3 | | Definition date: | 2020-05-26 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | 1-acetyl-N-methyl-N-phenylpiperidine-4-carboxamide |
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 | | UQJ | | Name: | 3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide | | Formula: | C6 H7 F2 N3 O | | SMILES: | NC(=O)c1c(C(F)F)nn(c1)C | | InChi: | InChI=1S/C6H7F2N3O/c1-11-2-3(6(9)12)4(10-11)5(7)8/h2,5H,1H3,(H2,9,12) | | Definition date: | 2020-05-27 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | 3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxamide |
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 | | UQM | | Name: | N-[4-(2-amino-2-oxoethyl)phenyl]acetamide | | Formula: | C10 H12 N2 O2 | | SMILES: | NC(Cc1ccc(NC(C)=O)cc1)=O | | InChi: | InChI=1S/C10H12N2O2/c1-7(13)12-9-4-2-8(3-5-9)6-10(11)14/h2-5H,6H2,1H3,(H2,11,14)(H,12,13) | | Definition date: | 2020-05-27 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | N-[4-(2-amino-2-oxoethyl)phenyl]acetamide |
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 | | UQS | | Name: | N-[(2-fluorophenyl)methyl]-1H-pyrazol-4-amine | | Formula: | C10 H10 F N3 | | SMILES: | n2ncc(NCc1ccccc1F)c2 | | InChi: | InChI=1S/C10H10FN3/c11-10-4-2-1-3-8(10)5-12-9-6-13-14-7-9/h1-4,6-7,12H,5H2,(H,13,14) | | Definition date: | 2020-05-27 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | N-[(2-fluorophenyl)methyl]-1H-pyrazol-4-amine |
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 | | UQV | | Name: | [2-(acetylamino)phenyl]acetic acid | | Formula: | C10 H11 N O3 | | SMILES: | c1ccc(CC(=O)O)c(NC(C)=O)c1 | | InChi: | InChI=1S/C10H11NO3/c1-7(12)11-9-5-3-2-4-8(9)6-10(13)14/h2-5H,6H2,1H3,(H,11,12)(H,13,14) | | Definition date: | 2020-05-27 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | [2-(acetylamino)phenyl]acetic acid |
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 | | UQY | | Name: | 1-(methylamino)cyclopentane-1-carboxamide | | Formula: | C7 H14 N2 O | | SMILES: | NC(=O)C1(CCCC1)NC | | InChi: | InChI=1S/C7H14N2O/c1-9-7(6(8)10)4-2-3-5-7/h9H,2-5H2,1H3,(H2,8,10) | | Definition date: | 2020-05-27 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | 1-(methylamino)cyclopentane-1-carboxamide |
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 | | UR1 | | Name: | 3-fluoro-5-methylbenzene-1-sulfonamide | | Formula: | C7 H8 F N O2 S | | SMILES: | c1c(S(N)(=O)=O)cc(C)cc1F | | InChi: | InChI=1S/C7H8FNO2S/c1-5-2-6(8)4-7(3-5)12(9,10)11/h2-4H,1H3,(H2,9,10,11) | | Definition date: | 2020-05-27 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | 3-fluoro-5-methylbenzene-1-sulfonamide |
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 | | UR7 | | Name: | 1-(3-fluoro-4-methylphenyl)methanesulfonamide | | Formula: | C8 H10 F N O2 S | | SMILES: | c1(cc(F)c(C)cc1)CS(N)(=O)=O | | InChi: | InChI=1S/C8H10FNO2S/c1-6-2-3-7(4-8(6)9)5-13(10,11)12/h2-4H,5H2,1H3,(H2,10,11,12) | | Definition date: | 2020-05-27 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | 1-(3-fluoro-4-methylphenyl)methanesulfonamide |
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 | | US7 | | Name: | 1-[4-(methylsulfonyl)phenyl]piperazine | | Formula: | C11 H16 N2 O2 S | | SMILES: | N2CCN(c1ccc(S(=O)(C)=O)cc1)CC2 | | InChi: | InChI=1S/C11H16N2O2S/c1-16(14,15)11-4-2-10(3-5-11)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3 | | Definition date: | 2020-05-28 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | 1-[4-(methylsulfonyl)phenyl]piperazine |
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 | | USA | | Name: | (E)-1-(1H-imidazol-2-yl)methanimine | | Formula: | C4 H5 N3 | | SMILES: | n1ccnc1/C=N | | InChi: | InChI=1S/C4H5N3/c5-3-4-6-1-2-7-4/h1-3,5H,(H,6,7)/b5-3+ | | Definition date: | 2020-05-28 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | (E)-1-(1H-imidazol-2-yl)methanimine |
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 | | USD | | Name: | (E)-1-(pyrimidin-2-yl)methanimine | | Formula: | C5 H5 N3 | | SMILES: | n1cccnc1/C=N | | InChi: | InChI=1S/C5H5N3/c6-4-5-7-2-1-3-8-5/h1-4,6H/b6-4+ | | Definition date: | 2020-05-28 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | (E)-1-(pyrimidin-2-yl)methanimine |
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 | | USJ | | Name: | (1S,3S)-2-methyl-2,3-dihydro-1H-isoindole-1,3-diol | | Formula: | C9 H11 N O2 | | SMILES: | c1cc2c(cc1)C(N(C2O)C)O | | InChi: | InChI=1S/C9H11NO2/c1-10-8(11)6-4-2-3-5-7(6)9(10)12/h2-5,8-9,11-12H,1H3/t8-,9-/m0/s1 | | Definition date: | 2020-05-29 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | (1S,3S)-2-methyl-2,3-dihydro-1H-isoindole-1,3-diol |
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 | | USP | | Name: | (2R)-6-amino-3-methyl-2,3-dihydro-1,3-benzoxazol-2-ol | | Formula: | C8 H10 N2 O2 | | SMILES: | c1(ccc2c(c1)OC(O)N2C)N | | InChi: | InChI=1S/C8H10N2O2/c1-10-6-3-2-5(9)4-7(6)12-8(10)11/h2-4,8,11H,9H2,1H3/t8-/m1/s1 | | Definition date: | 2020-05-29 | | Last modified: | 2020-06-05 | | Release date: | 2020-06-10 | | Identifier: | (2R)-6-amino-3-methyl-2,3-dihydro-1,3-benzoxazol-2-ol |
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 | | GNJ | | Name: | 4-hydroxy-8-sulfoquinoline-3-carboxylic acid | | Formula: | C10 H7 N O6 S | | SMILES: | c1c(c2ncc(c(c2cc1)O)C(=O)O)S(O)(=O)=O | | InChi: | InChI=1S/C10H7NO6S/c12-9-5-2-1-3-7(18(15,16)17)8(5)11-4-6(9)10(13)14/h1-4H,(H,11,12)(H,13,14)(H,15,16,17) | | Definition date: | 2018-05-30 | | Last modified: | 2020-06-01 | | Release date: | 2019-05-29 | | Identifier: | 4-hydroxy-8-sulfoquinoline-3-carboxylic acid |
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 | | 0TM | | Name: | 2-{[4-(2-chloro-4,5-dimethoxyphenyl)-5-cyano-7H-pyrrolo[2,3-d]pyrimidin-2-yl]sulfanyl}-N,N-dimethylacetamide | | Formula: | C19 H18 Cl N5 O3 S | | SMILES: | Clc3cc(OC)c(OC)cc3c1nc(nc2c1c(C#N)cn2)SCC(=O)N(C)C | | InChi: | InChI=1S/C19H18ClN5O3S/c1-25(2)15(26)9-29-19-23-17(16-10(7-21)8-22-18(16)24-19)11-5-13(27-3)14(28-4)6-12(11)20/h5-6,8H,9H2,1-4H3,(H,22,23,24) | | Definition date: | 2012-06-07 | | Last modified: | 2020-06-01 | | Release date: | 2012-10-19 | | Identifier: | 2-{[4-(2-chloro-4,5-dimethoxyphenyl)-5-cyano-7H-pyrrolo[2,3-d]pyrimidin-2-yl]sulfanyl}-N,N-dimethylacetamide |
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 | | 8C1 | | Name: | 4-{[(3R)-piperidin-3-yl]oxy}-6-[(propan-2-yl)oxy]quinoline-7-carboxamide | | Formula: | C18 H23 N3 O3 | | SMILES: | c21cc(OC(C)C)c(cc1nccc2OC3CCCNC3)C(N)=O | | InChi: | InChI=1S/C18H23N3O3/c1-11(2)23-17-9-13-15(8-14(17)18(19)22)21-7-5-16(13)24-12-4-3-6-20-10-12/h5,7-9,11-12,20H,3-4,6,10H2,1-2H3,(H2,19,22)/t12-/m1/s1 | | Definition date: | 2017-01-18 | | Last modified: | 2020-06-01 | | Release date: | 2017-05-24 | | Identifier: | 4-{[(3R)-piperidin-3-yl]oxy}-6-[(propan-2-yl)oxy]quinoline-7-carboxamide |
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