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

Systemtic Name: prop-2-enyl (4S)-3-cyano-2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-6-methyl-4-(4-methylphenyl)-3,4-dihydropyridine-5-carboxylate Openeye Name: allyl (4S)-3-cyano-2-(2-ethoxy-2-oxo-ethyl)sulfanyl-6-methyl-4-(p-tolyl)-3,4-dihydropyridine-5-carboxylate CAS Name: (4S)-3-cyano-2-[(2-ethoxy-2-oxoethyl)thio]-6-methyl-4-(4-methylphenyl)-3,4-dihydropyridine-5-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (4S)-3-cyano-2-(2-ethoxy-2-oxoethyl)sulfanyl-6-methyl-4-(4-methylphenyl)-3,4-dihydropyridine-5-carboxylate Traditional Name: (4S)-3-cyano-2-[(2-ethoxy-2-keto-ethyl)thio]-6-methyl-4-(p-tolyl)-3,4-dihydropyridine-5-carboxylic acid allyl ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O4S/c1-5-11-28-22(26)19-15(4)24-21(29-13-18(25)27-6-2)17(12-23)20(19)16-9-7-14(3)8-10-16/h5,7-10,17,20H,1,6,11,13H2,2-4H3/t17?,20-/m1/s1