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

Systemtic Name: prop-2-enyl 5-cyano-6-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate Openeye Name: allyl 5-cyano-6-[2-(3-methoxyanilino)-2-oxo-ethyl]sulfanyl-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-6-[[2-(3-methoxyanilino)-2-oxoethyl]thio]-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 5-cyano-6-[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-keto-2-(m-anisidino)ethyl]thio]-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C26H25N3O4S MolecularWeight: 475.5594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)NC2=CC(=CC=C2)OC)C#N)C3=CC=CC=C3)C(=O)OCC=C

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC(=O)NC2=CC(=CC=C2)OC)C#N)C3=CC=CC=C3)C(=O)OCC=C

InChI

InChI=1S/C26H25N3O4S/c1-4-13-33-26(31)23-17(2)28-25(21(15-27)24(23)18-9-6-5-7-10-18)34-16-22(30)29-19-11-8-12-20(14-19)32-3/h4-12,14,24,28H,1,13,16H2,2-3H3,(H,29,30)