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

Systemtic Name: methyl 6-cyano-5-methyl-2-sulfanyl-4-thiophen-3-yl-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 6-cyano-5-methyl-2-sulfanyl-4-(3-thienyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 6-cyano-2-mercapto-5-methyl-4-(3-thiophenyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 6-cyano-5-methyl-2-sulfanyl-4-thiophen-3-yl-1,4-dihydropyridine-3-carboxylate Traditional Name: 6-cyano-2-mercapto-5-methyl-4-(3-thienyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C13H12N2O2S2 MolecularWeight: 292.37658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C(C1C2=CSC=C2)C(=O)OC)S)C#N

Isomeric SMILES

CC1=C(NC(=C(C1C2=CSC=C2)C(=O)OC)S)C#N

InChI

InChI=1S/C13H12N2O2S2/c1-7-9(5-14)15-12(18)11(13(16)17-2)10(7)8-3-4-19-6-8/h3-4,6,10,15,18H,1-2H3