ethyl 5-cyano-2-methyl-6-sulfanyl-4-thiophen-3-yl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-methyl-6-sulfanyl-4-thiophen-3-yl-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-methyl-6-sulfanyl-4-(3-thienyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-6-mercapto-2-methyl-4-(3-thiophenyl)-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-methyl-6-sulfanyl-4-thiophen-3-yl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-6-mercapto-2-methyl-4-(3-thienyl)-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C14H14N2O2S2 MolecularWeight: 306.40316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CSC=C2)C#N)S)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CSC=C2)C#N)S)C

InChI

InChI=1S/C14H14N2O2S2/c1-3-18-14(17)11-8(2)16-13(19)10(6-15)12(11)9-4-5-20-7-9/h4-5,7,12,16,19H,3H2,1-2H3