Vitas-M small molecule compound
ethyl 5-cyano-4-(furan-2-yl)-6-[(2-oxo-2-phenylethyl)sulfanyl]-2-phenyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK827297
SMILES CCOC(=O)C1=C(NC(=C(C1c1ccco1)C#N)SCC(=O)c1ccccc1)c1ccccc1
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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 C27H22N2O4S MW 470.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O4S/c1-2-32-27(31)24-23(22-14-9-15-33-22)20(16-28)26(29-25(24)19-12-7-4-8-13-19)34-17-21(30)18-10-5-3-6-11-18/h3-15,23,29H,2,17H2,1H3InChIKey
STUQYYGOERVWIF-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=C(C1C2=CC=CO2)C#N)SCC(=O)C3=CC=CC=C3)C4=CC=CC=C4
ethyl5cyano4(furan2yl)6((2oxo2phenylethyl)sulfanyl)2phenyl14dihydropyridine3carboxylate
ethyl5cyano4(furan2yl)6phenacylsulfanyl2phenyl14dihydropyridine3carboxylate
InChI=1SC27H22N2O4Sc123227(31)2423(22149153322)20(1628)26(2925(24)19127481319)341721(30)18105361118h3152329H217H21H3
MFCD10087575
ZINC000020348192
ZINC000020348194
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