Vitas-M small molecule compound
benzyl 4-(4-chlorophenyl)-5-cyano-2-methyl-6-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK826515
SMILES N#CC1=C(SCC(=O)c2ccc(cc2)C)NC(=C(C1c1ccc(cc1)Cl)C(=O)OCc1ccccc1)C
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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 C30H25ClN2O3S MW 529.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25ClN2O3S/c1-19-8-10-22(11-9-19)26(34)18-37-29-25(16-32)28(23-12-14-24(31)15-13-23)27(20(2)33-29)30(35)36-17-21-6-4-3-5-7-21/h3-15,28,33H,17-18H2,1-2H3InChIKey
YGSGUDTXYOSJON-UHFFFAOYSA-NSynonyms
benzyl4(4chlorophenyl)5cyano2methyl6((2(4methylphenyl)2oxoethyl)sulfanyl)14dihydropyridine3carboxylate
benzyl4(4chlorophenyl)5cyano2methyl6(2(4methylphenyl)2oxoethyl)sulfanyl14dihydropyridine3carboxylate
CC1=CC=C(C=C1)C(=O)CSC2=C(C(C(=C(N2)C)C(=O)OCC3=CC=CC=C3)C4=CC=C(C=C4)Cl)C#N
InChI=1SC30H25ClN2O3Sc11981022(11919)26(34)18372925(1632)28(23121424(31)151323)27(20(2)3329)30(35)3617216435721h3152833H1718H212H3
MFCD10086470
ZINC000098048737
ZINC000098048738
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