Vitas-M small molecule compound
ethyl 4-(2-chlorophenyl)-5-cyano-6-[(2-ethoxy-2-oxoethyl)sulfanyl]-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK860560
SMILES CCOC(=O)CSC1=C(C#N)C(C(C(=O)N1)C(=O)OCC)c1ccccc1Cl
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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 C19H19ClN2O5S MW 422.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN2O5S/c1-3-26-14(23)10-28-18-12(9-21)15(11-7-5-6-8-13(11)20)16(17(24)22-18)19(25)27-4-2/h5-8,15-16H,3-4,10H2,1-2H3,(H,22,24)InChIKey
IHNADNXWVBEOFC-UHFFFAOYSA-NSynonyms
332045-83-7332045837
CCOC(=O)CSC1=C(C(C(C(=O)N1)C(=O)OCC)C2=CC=CC=C2Cl)C#N
ethyl4(2chlorophenyl)5cyano6((2ethoxy2oxoethyl)sulfanyl)2oxo1234tetrahydropyridine3carboxylate
ethyl4(2chlorophenyl)5cyano6((2ethoxy2oxoethyl)thio)2oxo1234tetrahydropyridine3carboxylate
ETHYL4(2CHLOROPHENYL)5CYANO6(2ETHOXY2OXOETHYL)SULFANYL2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
InChI=1SC19H19ClN2O5Sc132614(23)10281812(921)15(11756813(11)20)16(17(24)2218)19(25)2742h581516H3410H212H3(H2224)
MFCD01306860
ZINC000008971508
ZINC000008971514
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