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

Systemtic Name: methyl 6-cyano-5-methyl-4-pyridin-3-yl-2-sulfanyl-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 6-cyano-5-methyl-4-(3-pyridyl)-2-sulfanyl-1,4-dihydropyridine-3-carboxylate CAS Name: 6-cyano-2-mercapto-5-methyl-4-(3-pyridinyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 6-cyano-5-methyl-4-pyridin-3-yl-2-sulfanyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 6-cyano-2-mercapto-5-methyl-4-(3-pyridyl)-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C14H13N3O2S MolecularWeight: 287.33692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O2S/c1-8-10(6-15)17-13(20)12(14(18)19-2)11(8)9-4-3-5-16-7-9/h3-5,7,11,17,20H,1-2H3