prop-2-enyl 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: prop-2-enyl 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1,4-dihydropyridine-3-carboxylate Openeye Name: allyl 6-(2-anilino-2-oxo-ethyl)sulfanyl-5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxylate CAS Name: 6-[(2-anilino-2-oxoethyl)thio]-5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 6-(2-anilino-2-oxoethyl)sulfanyl-5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 6-[(2-anilino-2-keto-ethyl)thio]-5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C27H27N3O5S MolecularWeight: 505.58538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H27N3O5S/c1-5-13-35-27(32)24-17(2)29-26(36-16-23(31)30-19-9-7-6-8-10-19)20(15-28)25(24)18-11-12-21(33-3)22(14-18)34-4/h5-12,14,25,29H,1,13,16H2,2-4H3,(H,30,31)