Vitas-M small molecule compound
methyl 4-(4-chlorophenyl)-5-cyano-2-hydroxy-6-[(2-methoxy-2-oxoethyl)sulfanyl]-3,4-dihydropyridine-3-carboxylate
Catalog ID
STL147980
SMILES COC(=O)C1C(=NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)OC)O
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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 C17H15ClN2O5S MW 394.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15ClN2O5S/c1-24-12(21)8-26-16-11(7-19)13(9-3-5-10(18)6-4-9)14(15(22)20-16)17(23)25-2/h3-6,13-14H,8H2,1-2H3,(H,20,22)InChIKey
YFSHYHLNKSDTRS-UHFFFAOYSA-NSynonyms
361478-16-2361478162
4(4CHLOROPHENYL)5CYANO2KETO6((2KETO2METHOXYETHYL)THIO)34DIHYDRO1HPYRIDINE3CARBOXYLICACIDMETHYLESTER
4(4CHLOROPHENYL)5CYANO6((2METHOXY2OXOETHYL)THIO)2OXO34DIHYDRO1HPYRIDINE3CARBOXYLICACIDMETHYLESTER
COC(=O)CSC1=C(C(C(C(=O)N1)C(=O)OC)C2=CC=C(C=C2)Cl)C#N
InChI=1SC17H15ClN2O5Sc12412(21)8261611(719)13(93510(18)649)14(15(22)2016)17(23)252h361314H8H212H3(H2022)
methyl4(4chlorophenyl)5cyano2hydroxy6((2methoxy2oxoethyl)sulfanyl)34dihydropyridine3carboxylate
METHYL4(4CHLOROPHENYL)5CYANO6(2METHOXY2OXIDANYLIDENEETHYL)SULFANYL2OXIDANYLIDENE34DIHYDRO1HPYRIDINE3CARBOXYLATE
METHYL4(4CHLOROPHENYL)5CYANO6(2METHOXY2OXOETHYL)SULFANYL2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
MFCD03813934
ZINC000002300865
ZINC000002300868
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