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

Systemtic Name: prop-2-enyl 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-sulfanyl-1,4-dihydropyridine-3-carboxylate Openeye Name: allyl 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-sulfanyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-4-(3,4-dimethoxyphenyl)-6-mercapto-2-methyl-1,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-sulfanyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-4-(3,4-dimethoxyphenyl)-6-mercapto-2-methyl-1,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)S)C#N)C2=CC(=C(C=C2)OC)OC)C(=O)OCC=C

Isomeric SMILES

CC1=C(C(C(=C(N1)S)C#N)C2=CC(=C(C=C2)OC)OC)C(=O)OCC=C

InChI

InChI=1S/C19H20N2O4S/c1-5-8-25-19(22)16-11(2)21-18(26)13(10-20)17(16)12-6-7-14(23-3)15(9-12)24-4/h5-7,9,17,21,26H,1,8H2,2-4H3