(phenylmethyl) 4-(2-chlorophenyl)-5-cyano-6-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: (phenylmethyl) 4-(2-chlorophenyl)-5-cyano-6-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate Openeye Name: benzyl 4-(2-chlorophenyl)-5-cyano-6-(2-ethoxy-2-oxo-ethyl)sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate CAS Name: 4-(2-chlorophenyl)-5-cyano-6-[(2-ethoxy-2-oxoethyl)thio]-2-methyl-1,4-dihydropyridine-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(2-chlorophenyl)-5-cyano-6-(2-ethoxy-2-oxoethyl)sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 4-(2-chlorophenyl)-5-cyano-6-[(2-ethoxy-2-keto-ethyl)thio]-2-methyl-1,4-dihydropyridine-3-carboxylic acid benzyl ester Formula: C25H23ClN2O4S MolecularWeight: 482.97912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C(C(=C(N1)C)C(=O)OCC2=CC=CC=C2)C3=CC=CC=C3Cl)C#N

Isomeric SMILES

CCOC(=O)CSC1=C(C(C(=C(N1)C)C(=O)OCC2=CC=CC=C2)C3=CC=CC=C3Cl)C#N

InChI

InChI=1S/C25H23ClN2O4S/c1-3-31-21(29)15-33-24-19(13-27)23(18-11-7-8-12-20(18)26)22(16(2)28-24)25(30)32-14-17-9-5-4-6-10-17/h4-12,23,28H,3,14-15H2,1-2H3