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

Systemtic Name: methyl 5-cyano-2-methyl-4-phenyl-6-sulfanyl-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-cyano-2-methyl-4-phenyl-6-sulfanyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-6-mercapto-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-cyano-2-methyl-4-phenyl-6-sulfanyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-6-mercapto-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C15H14N2O2S MolecularWeight: 286.34886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)S)C#N)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)S)C#N)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C15H14N2O2S/c1-9-12(15(18)19-2)13(10-6-4-3-5-7-10)11(8-16)14(20)17-9/h3-7,13,17,20H,1-2H3