methyl 5-cyano-6-(3-methoxy-3-oxidanylidene-propyl)sulfanyl-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 5-cyano-6-(3-methoxy-3-oxidanylidene-propyl)sulfanyl-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-cyano-6-(3-methoxy-3-oxo-propyl)sulfanyl-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-6-[(3-methoxy-3-oxopropyl)thio]-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-cyano-6-(3-methoxy-3-oxopropyl)sulfanyl-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-6-[(3-keto-3-methoxy-propyl)thio]-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C19H20N2O4S MolecularWeight: 372.4381

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O4S/c1-12-16(19(23)25-3)17(13-7-5-4-6-8-13)14(11-20)18(21-12)26-10-9-15(22)24-2/h4-8,17,21H,9-10H2,1-3H3