Vitas-M small molecule compound
2-{[3-cyano-4-(4-hydroxy-3-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Catalog ID
STK550462
SMILES N#CC1=C(SCC(=O)Nc2cccc(c2)C)NC2=C(C1c1ccc(c(c1)OC)O)C(=O)CCC2
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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 C26H25N3O4S MW 475.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O4S/c1-15-5-3-6-17(11-15)28-23(32)14-34-26-18(13-27)24(16-9-10-20(30)22(12-16)33-2)25-19(29-26)7-4-8-21(25)31/h3,5-6,9-12,24,29-30H,4,7-8,14H2,1-2H3,(H,28,32)InChIKey
KYNZZLCGEIJTPF-UHFFFAOYSA-NSynonyms
799770-07-32((3cyano4(4hydroxy3methoxyphenyl)5oxo145678hexahydroquinolin2yl)sulfanyl)N(3methylphenyl)acetamide
2((3cyano4(4hydroxy3methoxyphenyl)5oxo145678hexahydroquinolin2yl)thio)N(mtolyl)acetamide
2((3cyano4(4hydroxy3methoxyphenyl)5oxo4678tetrahydro1Hquinolin2yl)sulfanyl)N(3methylphenyl)acetamide
799770073
CC1=CC(=CC=C1)NC(=O)CSC2=C(C(C3=C(N2)CCCC3=O)C4=CC(=C(C=C4)O)OC)C#N
InChI=1SC26H25N3O4Sc11553617(1115)2823(32)14342618(1327)24(1691020(30)22(1216)332)2519(2926)74821(25)31h356912242930H47814H212H3(H2832)
MFCD03671347
ZINC000002203760
ZINC000002203764
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