Vitas-M small molecule compound
ethyl 4-{[3-cyano-4-(2-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-3-oxobutanoate
Catalog ID
STK548258
SMILES CCOC(=O)CC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccccc1OC
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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 C19H20N2O5S MW 388.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O5S/c1-3-26-18(24)8-12(22)11-27-19-15(10-20)14(9-17(23)21-19)13-6-4-5-7-16(13)25-2/h4-7,14H,3,8-9,11H2,1-2H3,(H,21,23)InChIKey
DSILYYSWCZECAP-UHFFFAOYSA-NSynonyms
684231-00-3684231003
CCOC(=O)CC(=O)CSC1=C(C(CC(=O)N1)C2=CC=CC=C2OC)C#N
ethyl4((3cyano4(2methoxyphenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)3oxobutanoate
ethyl4((3cyano4(2methoxyphenyl)6oxo1456tetrahydropyridin2yl)thio)3oxobutanoate
ETHYL4((5CYANO4(2METHOXYPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)3OXOBUTANOATE
InChI=1SC19H20N2O5Sc132618(24)812(22)11271915(1020)14(917(23)2119)13645716(13)252h4714H38911H212H3(H2123)
MFCD03664262
ZINC000009329863
ZINC000009329864
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