prop-2-enyl 4-(2-chlorophenyl)-5-cyano-2-methyl-6-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: prop-2-enyl 4-(2-chlorophenyl)-5-cyano-2-methyl-6-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-1,4-dihydropyridine-3-carboxylate Openeye Name: allyl 4-(2-chlorophenyl)-5-cyano-2-methyl-6-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-1,4-dihydropyridine-3-carboxylate CAS Name: 4-(2-chlorophenyl)-5-cyano-2-methyl-6-[[2-(4-methylphenyl)-2-oxoethyl]thio]-1,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-(2-chlorophenyl)-5-cyano-2-methyl-6-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 4-(2-chlorophenyl)-5-cyano-6-[[2-keto-2-(p-tolyl)ethyl]thio]-2-methyl-1,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C26H23ClN2O3S MolecularWeight: 478.99042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=C(C(C(=C(N2)C)C(=O)OCC=C)C3=CC=CC=C3Cl)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=C(C(C(=C(N2)C)C(=O)OCC=C)C3=CC=CC=C3Cl)C#N

InChI

InChI=1S/C26H23ClN2O3S/c1-4-13-32-26(31)23-17(3)29-25(33-15-22(30)18-11-9-16(2)10-12-18)20(14-28)24(23)19-7-5-6-8-21(19)27/h4-12,24,29H,1,13,15H2,2-3H3