Vitas-M small molecule compound
2-{[3-cyano-6-hydroxy-4-(4-methylphenyl)-4,5-dihydropyridin-2-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide
Catalog ID
STK581640
SMILES N#CC1=C(SCC(=O)Nc2c(C)cccc2C)N=C(CC1c1ccc(cc1)C)O
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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 C23H23N3O2S MW 405.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O2S/c1-14-7-9-17(10-8-14)18-11-20(27)26-23(19(18)12-24)29-13-21(28)25-22-15(2)5-4-6-16(22)3/h4-10,18H,11,13H2,1-3H3,(H,25,28)(H,26,27)InChIKey
MCQSVLHFFAPSES-UHFFFAOYSA-NSynonyms
796880-66-52((3cyano6hydroxy4(4methylphenyl)45dihydropyridin2yl)sulfanyl)N(26dimethylphenyl)acetamide
2((5CYANO4(4METHYLPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)N(26DIMETHYLPHENYL)ACETAMIDE
CC1=CC=C(C=C1)C2CC(=O)NC(=C2C#N)SCC(=O)NC3=C(C=CC=C3C)C
InChI=1SC23H23N3O2Sc1147917(10814)181120(27)2623(19(18)1224)291321(28)252215(2)54616(22)3h41018H1113H213H3(H2528)(H2627)
MFCD07205305
ZINC000009088908
ZINC000009088909
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