Vitas-M small molecule compound
2-{[3-cyano-4-(2-ethoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2,4-dimethylphenyl)acetamide
Catalog ID
STK841465
SMILES CCOc1ccccc1C1C(=C(SCC(=O)Nc2ccc(cc2C)C)NC2=C1C(=O)CCC2)C#N
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H29N3O3S MW 487.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O3S/c1-4-34-24-11-6-5-8-19(24)26-20(15-29)28(31-22-9-7-10-23(32)27(22)26)35-16-25(33)30-21-13-12-17(2)14-18(21)3/h5-6,8,11-14,26,31H,4,7,9-10,16H2,1-3H3,(H,30,33)InChIKey
FZTQRLASILLPEZ-UHFFFAOYSA-NSynonyms
499117-01-02((3cyano4(2ethoxyphenyl)5oxo145678hexahydroquinolin2yl)sulfanyl)N(24dimethylphenyl)acetamide
2((3cyano4(2ethoxyphenyl)5oxo145678hexahydroquinolin2yl)thio)N(24dimethylphenyl)acetamide
2((3cyano4(2ethoxyphenyl)5oxo4678tetrahydro1Hquinolin2yl)sulfanyl)N(24dimethylphenyl)acetamide
499117010
CCOC1=CC=CC=C1C2C(=C(NC3=C2C(=O)CCC3)SCC(=O)NC4=C(C=C(C=C4)C)C)C#N
InChI=1SC28H29N3O3Sc1434241165819(24)2620(1529)28(3122971023(32)27(22)26)351625(33)3021131217(2)1418(21)3h56811142631H4791016H213H3(H3033)
MFCD03302461
ZINC000002351695
ZINC000002351697
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