Vitas-M small molecule compound
methyl {[3-cyano-4-(2-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate
Catalog ID
STK860528
SMILES CCOc1ccccc1C1CC(=O)NC(=C1C#N)SCC(=O)OC
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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 C17H18N2O4S MW 346.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O4S/c1-3-23-14-7-5-4-6-11(14)12-8-15(20)19-17(13(12)9-18)24-10-16(21)22-2/h4-7,12H,3,8,10H2,1-2H3,(H,19,20)InChIKey
IDWZHYWKDIGOMD-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC=C1C2CC(=O)NC(=C2C#N)SCC(=O)OC
InChI=1SC17H18N2O4Sc132314754611(14)12815(20)1917(13(12)918)241016(21)222h4712H3810H212H3(H1920)
methyl((3cyano4(2ethoxyphenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)acetate
methyl2((3cyano4(2ethoxyphenyl)6oxo1456tetrahydropyridin2yl)thio)acetate
METHYL2((5CYANO4(2ETHOXYPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)ACETATE
MFCD01464580
ZINC000009088886
ZINC000009088887
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Check stock on Vitas-MAvailable files
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