 | | WB6 | | Name: | 5-chloro-N,1-dimethyl-N-[(2S)-pentan-2-yl]-1H-imidazole-4-sulfonamide | | Formula: | C10 H18 Cl N3 O2 S | | SMILES: | Clc1c(ncn1C)S(=O)(=O)N(C)C(C)CCC | | InChi: | InChI=1S/C10H18ClN3O2S/c1-5-6-8(2)14(4)17(15,16)10-9(11)13(3)7-12-10/h7-8H,5-6H2,1-4H3/t8-/m0/s1 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 5-chloro-N,1-dimethyl-N-[(2S)-pentan-2-yl]-1H-imidazole-4-sulfonamide |
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 | | UYR | | Name: | (2E)-2-cyano-3-(thiophen-3-yl)prop-2-enamide | | Formula: | C8 H6 N2 O S | | SMILES: | O=C(N)C(=C/c1ccsc1)/C#N | | InChi: | InChI=1S/C8H6N2OS/c9-4-7(8(10)11)3-6-1-2-12-5-6/h1-3,5H,(H2,10,11)/b7-3+ | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (2E)-2-cyano-3-(thiophen-3-yl)prop-2-enamide |
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 | | VTW | | Name: | 3-phenyl-1,2-oxazole-5-carboxylic acid | | Formula: | C10 H7 N O3 | | SMILES: | O=C(O)c1cc(no1)c1ccccc1 | | InChi: | InChI=1S/C10H7NO3/c12-10(13)9-6-8(11-14-9)7-4-2-1-3-5-7/h1-6H,(H,12,13) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 3-phenyl-1,2-oxazole-5-carboxylic acid |
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 | | WBB | | Name: | N-methoxy-2-(2-methylphenyl)acetamide | | Formula: | C10 H13 N O2 | | SMILES: | O=C(Cc1ccccc1C)NOC | | InChi: | InChI=1S/C10H13NO2/c1-8-5-3-4-6-9(8)7-10(12)11-13-2/h3-6H,7H2,1-2H3,(H,11,12) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N-methoxy-2-(2-methylphenyl)acetamide |
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 | | VEX | | Name: | (2,3,4-trimethoxyphenyl)methanol | | Formula: | C10 H14 O4 | | SMILES: | COc1c(OC)c(ccc1OC)CO | | InChi: | InChI=1S/C10H14O4/c1-12-8-5-4-7(6-11)9(13-2)10(8)14-3/h4-5,11H,6H2,1-3H3 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (2,3,4-trimethoxyphenyl)methanol |
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 | | WBF | | Name: | 2-[(2-fluorophenyl)sulfanyl]acetohydrazide | | Formula: | C8 H9 F N2 O S | | SMILES: | NNC(=O)CSc1ccccc1F | | InChi: | InChI=1S/C8H9FN2OS/c9-6-3-1-2-4-7(6)13-5-8(12)11-10/h1-4H,5,10H2,(H,11,12) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 2-[(2-fluorophenyl)sulfanyl]acetohydrazide |
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 | | VU5 | | Name: | 1-[(2S)-2-hydroxy-3-(methylamino)propyl]pyrrolidin-2-one | | Formula: | C8 H16 N2 O2 | | SMILES: | O=C1CCCN1CC(O)CNC | | InChi: | InChI=1S/C8H16N2O2/c1-9-5-7(11)6-10-4-2-3-8(10)12/h7,9,11H,2-6H2,1H3/t7-/m0/s1 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 1-[(2S)-2-hydroxy-3-(methylamino)propyl]pyrrolidin-2-one |
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 | | WBL | | Name: | propyl (2S)-2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]propanoate | | Formula: | C8 H13 N3 O2 S2 | | SMILES: | Nc1nnc(SC(C)C(=O)OCCC)s1 | | InChi: | InChI=1S/C8H13N3O2S2/c1-3-4-13-6(12)5(2)14-8-11-10-7(9)15-8/h5H,3-4H2,1-2H3,(H2,9,10)/t5-/m0/s1 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | propyl (2S)-2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]propanoate |
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 | | VF9 | | Name: | 1-[(2S)-2-(furan-2-yl)azepan-1-yl]ethan-1-one | | Formula: | C12 H17 N O2 | | SMILES: | CC(=O)N1CCCCCC1c1ccco1 | | InChi: | InChI=1S/C12H17NO2/c1-10(14)13-8-4-2-3-6-11(13)12-7-5-9-15-12/h5,7,9,11H,2-4,6,8H2,1H3/t11-/m0/s1 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 1-[(2S)-2-(furan-2-yl)azepan-1-yl]ethan-1-one |
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 | | WTN | | Name: | (6S,8R)-N-[(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)carbamoyl]-6-(methylamino)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-sulfonamide | | Formula: | C20 H25 N5 O4 S | | SMILES: | O=C(Nc1c2CCCc2cc2CCCc21)NS(=O)(=O)c1cnn2CC(COc12)NC | | InChi: | InChI=1S/C20H25N5O4S/c1-21-14-10-25-19(29-11-14)17(9-22-25)30(27,28)24-20(26)23-18-15-6-2-4-12(15)8-13-5-3-7-16(13)18/h8-9,14,21H,2-7,10-11H2,1H3,(H2,23,24,26)/t14-/m0/s1 | | Definition date: | 2022-10-18 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (6S,8R)-N-[(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)carbamoyl]-6-(methylamino)-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-sulfonamide |
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 | | UZ8 | | Name: | [2-(methylsulfanyl)pyridin-3-yl](pyrrolidin-1-yl)methanone | | Formula: | C11 H14 N2 O S | | SMILES: | O=C(c1cccnc1SC)N1CCCC1 | | InChi: | InChI=1S/C11H14N2OS/c1-15-10-9(5-4-6-12-10)11(14)13-7-2-3-8-13/h4-6H,2-3,7-8H2,1H3 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | [2-(methylsulfanyl)pyridin-3-yl](pyrrolidin-1-yl)methanone |
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 | | VUE | | Name: | 2-(4-chloro-2-nitroanilino)ethan-1-ol | | Formula: | C8 H9 Cl N2 O3 | | SMILES: | Clc1cc(c(NCCO)cc1)N(=O)=O | | InChi: | InChI=1S/C8H9ClN2O3/c9-6-1-2-7(10-3-4-12)8(5-6)11(13)14/h1-2,5,10,12H,3-4H2 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 2-(4-chloro-2-nitroanilino)ethan-1-ol |
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 | | WBX | | Name: | methyl [4-(1,3-thiazol-2-yl)piperazin-1-yl]acetate | | Formula: | C10 H15 N3 O2 S | | SMILES: | O=C(OC)CN1CCN(CC1)c1nccs1 | | InChi: | InChI=1S/C10H15N3O2S/c1-15-9(14)8-12-3-5-13(6-4-12)10-11-2-7-16-10/h2,7H,3-6,8H2,1H3 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | methyl [4-(1,3-thiazol-2-yl)piperazin-1-yl]acetate |
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 | | VUI | | Name: | 4-bromo-1-(2-methoxyethoxy)-2-nitrobenzene | | Formula: | C9 H10 Br N O4 | | SMILES: | Brc1cc(c(OCCOC)cc1)N(=O)=O | | InChi: | InChI=1S/C9H10BrNO4/c1-14-4-5-15-9-3-2-7(10)6-8(9)11(12)13/h2-3,6H,4-5H2,1H3 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 4-bromo-1-(2-methoxyethoxy)-2-nitrobenzene |
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 | | VUN | | Name: | 4-{[(propan-2-yl)oxy]methyl}benzoic acid | | Formula: | C11 H14 O3 | | SMILES: | O=C(O)c1ccc(COC(C)C)cc1 | | InChi: | InChI=1S/C11H14O3/c1-8(2)14-7-9-3-5-10(6-4-9)11(12)13/h3-6,8H,7H2,1-2H3,(H,12,13) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 4-{[(propan-2-yl)oxy]methyl}benzoic acid |
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 | | VFL | | Name: | (2R)-1-amino-3-(2,4-dimethylphenoxy)propan-2-ol | | Formula: | C11 H17 N O2 | | SMILES: | NCC(O)COc1ccc(C)cc1C | | InChi: | InChI=1S/C11H17NO2/c1-8-3-4-11(9(2)5-8)14-7-10(13)6-12/h3-5,10,13H,6-7,12H2,1-2H3/t10-/m1/s1 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (2R)-1-amino-3-(2,4-dimethylphenoxy)propan-2-ol |
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 | | WC6 | | Name: | 1-(3-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-one | | Formula: | C10 H8 F N3 O | | SMILES: | O=C(Cn1cncn1)c1cccc(F)c1 | | InChi: | InChI=1S/C10H8FN3O/c11-9-3-1-2-8(4-9)10(15)5-14-7-12-6-13-14/h1-4,6-7H,5H2 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 1-(3-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-one |
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 | | VFR | | Name: | (3E)-N-benzyl-3-(hydroxyamino)-3-iminopropanamide | | Formula: | C10 H13 N3 O2 | | SMILES: | N=C(NO)CC(=O)NCc1ccccc1 | | InChi: | InChI=1S/C10H13N3O2/c11-9(13-15)6-10(14)12-7-8-4-2-1-3-5-8/h1-5,15H,6-7H2,(H2,11,13)(H,12,14) | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (3E)-N-benzyl-3-(hydroxyamino)-3-iminopropanamide |
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 | | VUU | | Name: | N-cyclopropyl-N'-[2-(thiophen-2-yl)ethyl]guanidine | | Formula: | C10 H15 N3 S | | SMILES: | N=C(NCCc1cccs1)NC1CC1 | | InChi: | InChI=1S/C10H15N3S/c11-10(13-8-3-4-8)12-6-5-9-2-1-7-14-9/h1-2,7-8H,3-6H2,(H3,11,12,13) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N-cyclopropyl-N'-[2-(thiophen-2-yl)ethyl]guanidine |
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 | | WCB | | Name: | 1-[(2S)-2-methylmorpholin-4-yl]-2-(thiophen-3-yl)ethan-1-one | | Formula: | C11 H15 N O2 S | | SMILES: | O=C(Cc1ccsc1)N1CC(C)OCC1 | | InChi: | InChI=1S/C11H15NO2S/c1-9-7-12(3-4-14-9)11(13)6-10-2-5-15-8-10/h2,5,8-9H,3-4,6-7H2,1H3/t9-/m0/s1 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 1-[(2S)-2-methylmorpholin-4-yl]-2-(thiophen-3-yl)ethan-1-one |
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 | | VV0 | | Name: | 4-amino-3-methyl-N-(propan-2-yl)benzamide | | Formula: | C11 H16 N2 O | | SMILES: | Cc1cc(ccc1N)C(=O)NC(C)C | | InChi: | InChI=1S/C11H16N2O/c1-7(2)13-11(14)9-4-5-10(12)8(3)6-9/h4-7H,12H2,1-3H3,(H,13,14) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 4-amino-3-methyl-N-(propan-2-yl)benzamide |
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 | | WCI | | Name: | N-(3,4-dichlorophenyl)-2-(1H-pyrazol-1-yl)acetamide | | Formula: | C11 H9 Cl2 N3 O | | SMILES: | O=C(Nc1ccc(Cl)c(Cl)c1)Cn1cccn1 | | InChi: | InChI=1S/C11H9Cl2N3O/c12-9-3-2-8(6-10(9)13)15-11(17)7-16-5-1-4-14-16/h1-6H,7H2,(H,15,17) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N-(3,4-dichlorophenyl)-2-(1H-pyrazol-1-yl)acetamide |
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 | | VV5 | | Name: | N-[2-(thiophen-2-yl)ethyl]pyridine-3-carboxamide | | Formula: | C12 H12 N2 O S | | SMILES: | O=C(NCCc1cccs1)c1cccnc1 | | InChi: | InChI=1S/C12H12N2OS/c15-12(10-3-1-6-13-9-10)14-7-5-11-4-2-8-16-11/h1-4,6,8-9H,5,7H2,(H,14,15) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N-[2-(thiophen-2-yl)ethyl]pyridine-3-carboxamide |
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 | | V03 | | Name: | (3S)-3-amino-3-(4-methoxyphenyl)propan-1-ol | | Formula: | C10 H15 N O2 | | SMILES: | COc1ccc(cc1)C(N)CCO | | InChi: | InChI=1S/C10H15NO2/c1-13-9-4-2-8(3-5-9)10(11)6-7-12/h2-5,10,12H,6-7,11H2,1H3/t10-/m0/s1 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (3S)-3-amino-3-(4-methoxyphenyl)propan-1-ol |
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 | | WCT | | Name: | 3-methyl-N-[(3S)-4,4,4-trifluoro-3-hydroxybutyl]-1,2-oxazole-5-carboxamide | | Formula: | C9 H11 F3 N2 O3 | | SMILES: | O=C(NCCC(O)C(F)(F)F)c1cc(C)no1 | | InChi: | InChI=1S/C9H11F3N2O3/c1-5-4-6(17-14-5)8(16)13-3-2-7(15)9(10,11)12/h4,7,15H,2-3H2,1H3,(H,13,16)/t7-/m0/s1 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 3-methyl-N-[(3S)-4,4,4-trifluoro-3-hydroxybutyl]-1,2-oxazole-5-carboxamide |
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