ethyl (4R)-5-cyano-6-methylsulfanyl-2,4-diphenyl-3,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl (4R)-5-cyano-6-methylsulfanyl-2,4-diphenyl-3,4-dihydropyridine-3-carboxylate Openeye Name: ethyl (4R)-5-cyano-6-methylsulfanyl-2,4-diphenyl-3,4-dihydropyridine-3-carboxylate CAS Name: (4R)-5-cyano-6-(methylthio)-2,4-diphenyl-3,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-5-cyano-6-methylsulfanyl-2,4-diphenyl-3,4-dihydropyridine-3-carboxylate Traditional Name: (4R)-5-cyano-6-(methylthio)-2,4-diphenyl-3,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C22H20N2O2S MolecularWeight: 376.4714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(=C(N=C1C2=CC=CC=C2)SC)C#N)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1[C@@H](C(=C(N=C1C2=CC=CC=C2)SC)C#N)C3=CC=CC=C3

InChI

InChI=1S/C22H20N2O2S/c1-3-26-22(25)19-18(15-10-6-4-7-11-15)17(14-23)21(27-2)24-20(19)16-12-8-5-9-13-16/h4-13,18-19H,3H2,1-2H3/t18-,19?/m1/s1