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

Systemtic Name: prop-2-enyl 5-cyano-2-methyl-6-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1,4-dihydropyridine-3-carboxylate Openeye Name: allyl 5-cyano-2-methyl-6-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-4-phenyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-[[2-(4-methylanilino)-2-oxoethyl]thio]-4-phenyl-1,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 5-cyano-2-methyl-6-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-4-phenyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-keto-2-(p-toluidino)ethyl]thio]-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C26H25N3O3S MolecularWeight: 459.56

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H25N3O3S/c1-4-14-32-26(31)23-18(3)28-25(21(15-27)24(23)19-8-6-5-7-9-19)33-16-22(30)29-20-12-10-17(2)11-13-20/h4-13,24,28H,1,14,16H2,2-3H3,(H,29,30)