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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=C(C(C1C#N)C2=CC=CC=C2)C(=O)OCC)C

Isomeric SMILES

CCOC(=O)CSC1=NC(=C([C@@H](C1C#N)C2=CC=CC=C2)C(=O)OCC)C

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/h6-10,15,18H,4-5,12H2,1-3H3/t15?,18-/m1/s1