Vitas-M small molecule compound
2-{[3-cyano-6-hydroxy-4-(2-methylphenyl)-4,5-dihydropyridin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Catalog ID
STK851616
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)F)N=C(CC1c1ccccc1C)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 C21H18FN3O2S MW 395.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN3O2S/c1-13-4-2-3-5-16(13)17-10-19(26)25-21(18(17)11-23)28-12-20(27)24-15-8-6-14(22)7-9-15/h2-9,17H,10,12H2,1H3,(H,24,27)(H,25,26)InChIKey
BBPGBMIRVYMHJJ-UHFFFAOYSA-NSynonyms
500147-34-22((3cyano6hydroxy4(2methylphenyl)45dihydropyridin2yl)sulfanyl)N(4fluorophenyl)acetamide
2((5CYANO4(2METHYLPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)N(4FLUOROPHENYL)ACETAMIDE
500147342
CC1=CC=CC=C1C2CC(=O)NC(=C2C#N)SCC(=O)NC3=CC=C(C=C3)F
InChI=1SC21H18FN3O2Sc113423516(13)171019(26)2521(18(17)1123)281220(27)24158614(22)7915h2917H1012H21H3(H2427)(H2526)
MFCD07208743
ZINC000009013380
ZINC000009013381
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