Vitas-M small molecule compound

butyl {[3-cyano-4-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate

Catalog ID
STK826216
SMILES CCCCOC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccc(cc1)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 C19H22N2O3S MW 358.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2O3S/c1-3-4-9-24-18(23)12-25-19-16(11-20)15(10-17(22)21-19)14-7-5-13(2)6-8-14/h5-8,15H,3-4,9-10,12H2,1-2H3,(H,21,22)
InChIKey
WOLXTTITSVLYKP-UHFFFAOYSA-N
Synonyms
476298-88-1
476298881
butyl((3cyano4(4methylphenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)acetate
butyl2((3cyano6oxo4(ptolyl)1456tetrahydropyridin2yl)thio)acetate
BUTYL2((5CYANO4(4METHYLPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)ACETATE
MFCD03303895
ZINC000008969951
ZINC000008972662

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.