Vitas-M small molecule compound
2-{[3-cyano-4-(4-ethylphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Catalog ID
STK840920
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)F)NC(=O)CC1c1ccc(cc1)CC
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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 C22H20FN3O2S MW 409.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20FN3O2S/c1-2-14-3-5-15(6-4-14)18-11-20(27)26-22(19(18)12-24)29-13-21(28)25-17-9-7-16(23)8-10-17/h3-10,18H,2,11,13H2,1H3,(H,25,28)(H,26,27)InChIKey
JTTXSUPNCKACAF-UHFFFAOYSA-NSynonyms
489404-29-72((3cyano4(4ethylphenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)N(4fluorophenyl)acetamide
2((3cyano4(4ethylphenyl)6oxo1456tetrahydropyridin2yl)thio)N(4fluorophenyl)acetamide
2((5CYANO4(4ETHYLPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)N(4FLUOROPHENYL)ACETAMIDE
489404297
CCC1=CC=C(C=C1)C2CC(=O)NC(=C2C#N)SCC(=O)NC3=CC=C(C=C3)F
InChI=1SC22H20FN3O2Sc12143515(6414)181120(27)2622(19(18)1224)291321(28)25179716(23)81017h31018H21113H21H3(H2528)(H2627)
MFCD03296130
ZINC000009110200
ZINC000009110201
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