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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O4S/c1-12(2)26-16(23)11-27-19-15(10-21)18(14-8-6-5-7-9-14)17(13(3)22-19)20(24)25-4/h5-9,12,18,22H,11H2,1-4H3