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

Systemtic Name: ethyl 5-cyano-6-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-(2-ethoxy-2-oxo-ethyl)sulfanyl-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-6-[(2-ethoxy-2-oxoethyl)thio]-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-(2-ethoxy-2-oxoethyl)sulfanyl-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-6-[(2-ethoxy-2-keto-ethyl)thio]-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C(C(=C(N1)C)C(=O)OCC)C2=CC=CC=C2)C#N

Isomeric SMILES

CCOC(=O)CSC1=C(C(C(=C(N1)C)C(=O)OCC)C2=CC=CC=C2)C#N

InChI

InChI=1S/C20H22N2O4S/c1-4-25-16(23)12-27-19-15(11-21)18(14-9-7-6-8-10-14)17(13(3)22-19)20(24)26-5-2/h6-10,18,22H,4-5,12H2,1-3H3