methyl (4S)-5-cyano-2-methyl-6-(pyridin-3-ylmethylsulfanyl)-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl (4S)-5-cyano-2-methyl-6-(pyridin-3-ylmethylsulfanyl)-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl (4S)-5-cyano-2-methyl-6-(3-pyridylmethylsulfanyl)-4-(2-thienyl)-1,4-dihydropyridine-3-carboxylate CAS Name: (4S)-5-cyano-2-methyl-6-(3-pyridinylmethylthio)-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl (4S)-5-cyano-2-methyl-6-(pyridin-3-ylmethylsulfanyl)-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate Traditional Name: (4S)-5-cyano-2-methyl-6-(3-pyridylmethylthio)-4-(2-thienyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C19H17N3O2S2 MolecularWeight: 383.48718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC2=CN=CC=C2)C#N)C3=CC=CS3)C(=O)OC

Isomeric SMILES

CC1=C([C@@H](C(=C(N1)SCC2=CN=CC=C2)C#N)C3=CC=CS3)C(=O)OC

InChI

InChI=1S/C19H17N3O2S2/c1-12-16(19(23)24-2)17(15-6-4-8-25-15)14(9-20)18(22-12)26-11-13-5-3-7-21-10-13/h3-8,10,17,22H,11H2,1-2H3/t17-/m0/s1