Vitas-M small molecule compound
methyl 5-cyano-4-(4-methylphenyl)-6-[(2-methylprop-2-en-1-yl)sulfanyl]-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK887388
SMILES COC(=O)C1C(=O)NC(=C(C1c1ccc(cc1)C)C#N)SCC(=C)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 C19H20N2O3S MW 356.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O3S/c1-11(2)10-25-18-14(9-20)15(13-7-5-12(3)6-8-13)16(17(22)21-18)19(23)24-4/h5-8,15-16H,1,10H2,2-4H3,(H,21,22)InChIKey
IKPFYZROWPMKKJ-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C2C(C(=O)NC(=C2C#N)SCC(=C)C)C(=O)OC
InChI=1SC19H20N2O3Sc111(2)10251814(920)15(137512(3)6813)16(17(22)2118)19(23)244h581516H110H224H3(H2122)
methyl5cyano4(4methylphenyl)6((2methylprop2en1yl)sulfanyl)2oxo1234tetrahydropyridine3carboxylate
methyl5cyano4(4methylphenyl)6(2methylprop2enylsulfanyl)2oxo34dihydro1Hpyridine3carboxylate
MFCD18172044
ZINC000040486375
ZINC000040486381
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