Vitas-M small molecule compound
ethyl 5-cyano-4-[4-(methoxycarbonyl)phenyl]-2-methyl-6-[(2-oxo-2-phenylethyl)sulfanyl]-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK548877
SMILES CCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)C(=O)OC)C#N)SCC(=O)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 C26H24N2O5S MW 476.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O5S/c1-4-33-26(31)22-16(2)28-24(34-15-21(29)17-8-6-5-7-9-17)20(14-27)23(22)18-10-12-19(13-11-18)25(30)32-3/h5-13,23,28H,4,15H2,1-3H3InChIKey
UGSFFBMYOGLSPW-UHFFFAOYSA-NSynonyms
488109-27-9488109279
CCOC(=O)C1=C(NC(=C(C1C2=CC=C(C=C2)C(=O)OC)C#N)SCC(=O)C3=CC=CC=C3)C
ethyl5cyano4(4(methoxycarbonyl)phenyl)2methyl6((2oxo2phenylethyl)sulfanyl)14dihydropyridine3carboxylate
ethyl5cyano4(4(methoxycarbonyl)phenyl)2methyl6((2oxo2phenylethyl)thio)14dihydropyridine3carboxylate
ETHYL5CYANO4(4METHOXYCARBONYLPHENYL)2METHYL6PHENACYLSULFANYL14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC26H24N2O5Sc143326(31)2216(2)2824(341521(29)178657917)20(1427)23(22)18101219(131118)25(30)323h5132328H415H213H3
MFCD03289012
ZINC000001294606
ZINC000001294607
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