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

Systemtic Name: ethyl 5-cyano-4-(2,4-dichlorophenyl)-2-methyl-6-methylsulfanyl-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 5-cyano-4-(2,4-dichlorophenyl)-2-methyl-6-methylsulfanyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-4-(2,4-dichlorophenyl)-2-methyl-6-(methylthio)-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-4-(2,4-dichlorophenyl)-2-methyl-6-methylsulfanyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-4-(2,4-dichlorophenyl)-2-methyl-6-(methylthio)-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C17H16Cl2N2O2S MolecularWeight: 383.29214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16Cl2N2O2S/c1-4-23-17(22)14-9(2)21-16(24-3)12(8-20)15(14)11-6-5-10(18)7-13(11)19/h5-7,15,21H,4H2,1-3H3