Vitas-M small molecule compound
methyl 5-cyano-6-(ethylsulfanyl)-4-(2-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK839196
SMILES CCSC1=C(C#N)C(C(C(=O)N1)C(=O)OC)c1ccccc1C
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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 C17H18N2O3S MW 330.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O3S/c1-4-23-16-12(9-18)13(11-8-6-5-7-10(11)2)14(15(20)19-16)17(21)22-3/h5-8,13-14H,4H2,1-3H3,(H,19,20)InChIKey
ORWUFEPZRFMXEQ-UHFFFAOYSA-NSynonyms
CCSC1=C(C(C(C(=O)N1)C(=O)OC)C2=CC=CC=C2C)C#N
InChI=1SC17H18N2O3Sc14231612(918)13(11865710(11)2)14(15(20)1916)17(21)223h581314H4H213H3(H1920)
methyl5cyano6(ethylsulfanyl)4(2methylphenyl)2oxo1234tetrahydropyridine3carboxylate
methyl5cyano6(ethylthio)2oxo4(otolyl)1234tetrahydropyridine3carboxylate
METHYL5CYANO6ETHYLSULFANYL4(2METHYLPHENYL)2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
METHYL5CYANO6ETHYLTHIO4(2METHYLPHENYL)2OXO134TRIHYDROPYRIDINE3CARBOXYLATE
MFCD02232581
ZINC000009089338
ZINC000009332561
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