Vitas-M small molecule compound
benzyl 4-(4-chlorophenyl)-5-cyano-2-methyl-6-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK538194
SMILES N#CC1=C(SCC(=O)Nc2ccccc2)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 C29H24ClN3O3S MW 530.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24ClN3O3S/c1-19-26(29(35)36-17-20-8-4-2-5-9-20)27(21-12-14-22(30)15-13-21)24(16-31)28(32-19)37-18-25(34)33-23-10-6-3-7-11-23/h2-15,27,32H,17-18H2,1H3,(H,33,34)InChIKey
KEYCCIZEWHTWRU-UHFFFAOYSA-NSynonyms
370850-18-3370850183
benzyl4(4chlorophenyl)5cyano2methyl6((2oxo2(phenylamino)ethyl)sulfanyl)14dihydropyridine3carboxylate
benzyl4(4chlorophenyl)5cyano2methyl6((2oxo2(phenylamino)ethyl)thio)14dihydropyridine3carboxylate
BENZYL6(2ANILINO2OXOETHYL)SULFANYL4(4CHLOROPHENYL)5CYANO2METHYL14DIHYDROPYRIDINE3CARBOXYLATE
CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=CC=C2)C#N)C3=CC=C(C=C3)Cl)C(=O)OCC4=CC=CC=C4
InChI=1SC29H24ClN3O3Sc11926(29(35)3617208425920)27(21121422(30)151321)24(1631)28(3219)371825(34)3323106371123h2152732H1718H21H3(H3334)
MFCD02999794
ZINC000001820958
ZINC000033355306
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