ethyl 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-methylsulfanyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-methylsulfanyl-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-methylsulfanyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-(methylthio)-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-methylsulfanyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-6-(methylthio)-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC(=C(C=C2)OC)OC)C#N)SC)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC(=C(C=C2)OC)OC)C#N)SC)C

InChI

InChI=1S/C19H22N2O4S/c1-6-25-19(22)16-11(2)21-18(26-5)13(10-20)17(16)12-7-8-14(23-3)15(9-12)24-4/h7-9,17,21H,6H2,1-5H3