Vitas-M small molecule compound
methyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-4-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK826191
SMILES COC(=O)C1C(=O)NC(=C(C1c1ccc(cc1)C)C#N)SCC(=O)N
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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 C17H17N3O4S MW 359.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O4S/c1-9-3-5-10(6-4-9)13-11(7-18)16(25-8-12(19)21)20-15(22)14(13)17(23)24-2/h3-6,13-14H,8H2,1-2H3,(H2,19,21)(H,20,22)InChIKey
OAGKVOWNNWQVPT-UHFFFAOYSA-NSynonyms
361478-37-7361478377
CC1=CC=C(C=C1)C2C(C(=O)NC(=C2C#N)SCC(=O)N)C(=O)OC
InChI=1SC17H17N3O4Sc193510(649)1311(718)16(25812(19)21)2015(22)14(13)17(23)242h361314H8H212H3(H21921)(H2022)
methyl6((2amino2oxoethyl)sulfanyl)5cyano4(4methylphenyl)2oxo1234tetrahydropyridine3carboxylate
methyl6((2amino2oxoethyl)thio)5cyano2oxo4(ptolyl)1234tetrahydropyridine3carboxylate
METHYL6(2AMINO2OXOETHYL)SULFANYL5CYANO4(4METHYLPHENYL)2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
MFCD02999554
ZINC000002309973
ZINC000002309976
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