Vitas-M small molecule compound
2-{[3-cyano-4-(4-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide
Catalog ID
STK862767
SMILES CCOc1ccc(cc1)C1CC(=O)NC(=C1C#N)SCC(=O)Nc1c(C)cc(cc1C)C
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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 C25H27N3O3S MW 449.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O3S/c1-5-31-19-8-6-18(7-9-19)20-12-22(29)28-25(21(20)13-26)32-14-23(30)27-24-16(3)10-15(2)11-17(24)4/h6-11,20H,5,12,14H2,1-4H3,(H,27,30)(H,28,29)InChIKey
ZLVKHXOFTMLHJM-UHFFFAOYSA-NSynonyms
2((3cyano4(4ethoxyphenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)N(246trimethylphenyl)acetamide
2((5CYANO4(4ETHOXYPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)N(246TRIMETHYLPHENYL)ACETAMIDE
CCOC1=CC=C(C=C1)C2CC(=O)NC(=C2C#N)SCC(=O)NC3=C(C=C(C=C3C)C)C
InChI=1SC25H27N3O3Sc1531198618(7919)201222(29)2825(21(20)1326)321423(30)272416(3)1015(2)1117(24)4h61120H51214H214H3(H2730)(H2829)
MFCD03981674
ZINC000003248441
ZINC000003248443
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