Vitas-M small molecule compound
methyl {[3-cyano-4-(4-hydroxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate
Catalog ID
STK079506
SMILES COC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccc(cc1)O
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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 C15H14N2O4S MW 318.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N2O4S/c1-21-14(20)8-22-15-12(7-16)11(6-13(19)17-15)9-2-4-10(18)5-3-9/h2-5,11,18H,6,8H2,1H3,(H,17,19)InChIKey
FWYHNPLLDBSAAT-UHFFFAOYSA-NSynonyms
264254-96-8264254968
COC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccc(cc1)O
COC(=O)CSC1=C(C(CC(=O)N1)C2=CC=C(C=C2)O)C#N
InChI=1SC15H14N2O4Sc12114(20)8221512(716)11(613(19)1715)92410(18)539h251118H68H21H3(H1719)
methyl((3cyano4(4hydroxyphenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)acetate
methyl2((3cyano4(4hydroxyphenyl)6oxo1456tetrahydropyridin2yl)thio)acetate
METHYL2((5CYANO4(4HYDROXYPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)ACETATE
MFCD01464763
STK079506
ZINC000008972304
ZINC000008972968
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