methyl (4R)-5-cyano-2-methyl-6-sulfanyl-4-thiophen-2-yl-3,4-dihydropyridine-3-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)OC)C2=CC=CS2)C#N)S

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)OC)C2=CC=CS2)C#N)S

InChI

InChI=1S/C13H12N2O2S2/c1-7-10(13(16)17-2)11(9-4-3-5-19-9)8(6-14)12(18)15-7/h3-5,10-11,18H,1-2H3/t10?,11-/m1/s1