Vitas-M small molecule compound
methyl 6-{[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanyl}-4-(4-chlorophenyl)-5-cyano-2-hydroxy-3,4-dihydropyridine-3-carboxylate
Catalog ID
STK638475
SMILES COC(=O)C1C(=NC(=C(C1c1ccc(cc1)Cl)C#N)SCC(=O)Nc1ccc2c(c1)OCO2)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 C23H18ClN3O6S MW 499.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN3O6S/c1-31-23(30)20-19(12-2-4-13(24)5-3-12)15(9-25)22(27-21(20)29)34-10-18(28)26-14-6-7-16-17(8-14)33-11-32-16/h2-8,19-20H,10-11H2,1H3,(H,26,28)(H,27,29)InChIKey
CAKQPHWGYCTFQP-UHFFFAOYSA-NSynonyms
369398-31-2methyl6((2(13benzodioxol5ylamino)2oxoethyl)sulfanyl)4(4chlorophenyl)5cyano2hydroxy34dihydropyridine3carboxylate
METHYL6(2(13BENZODIOXOL5YLAMINO)2OXOETHYL)SULFANYL4(4CHLOROPHENYL)5CYANO2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
MFCD18161702
ZINC000002311138
ZINC000002311141
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