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

Systemtic Name: prop-2-enyl (4R)-3-cyano-2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-4-(2-methoxyphenyl)-6-methyl-3,4-dihydropyridine-5-carboxylate Openeye Name: allyl (4R)-3-cyano-2-(2-ethoxy-2-oxo-ethyl)sulfanyl-4-(2-methoxyphenyl)-6-methyl-3,4-dihydropyridine-5-carboxylate CAS Name: (4R)-3-cyano-2-[(2-ethoxy-2-oxoethyl)thio]-4-(2-methoxyphenyl)-6-methyl-3,4-dihydropyridine-5-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (4R)-3-cyano-2-(2-ethoxy-2-oxoethyl)sulfanyl-4-(2-methoxyphenyl)-6-methyl-3,4-dihydropyridine-5-carboxylate Traditional Name: (4R)-3-cyano-2-[(2-ethoxy-2-keto-ethyl)thio]-4-(2-methoxyphenyl)-6-methyl-3,4-dihydropyridine-5-carboxylic acid allyl ester Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=C(C(C1C#N)C2=CC=CC=C2OC)C(=O)OCC=C)C

Isomeric SMILES

CCOC(=O)CSC1=NC(=C([C@H](C1C#N)C2=CC=CC=C2OC)C(=O)OCC=C)C

InChI

InChI=1S/C22H24N2O5S/c1-5-11-29-22(26)19-14(3)24-21(30-13-18(25)28-6-2)16(12-23)20(19)15-9-7-8-10-17(15)27-4/h5,7-10,16,20H,1,6,11,13H2,2-4H3/t16?,20-/m0/s1