prop-2-enyl (4R)-4-(2-chlorophenyl)-5-cyano-6-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: prop-2-enyl (4R)-4-(2-chlorophenyl)-5-cyano-6-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate Openeye Name: allyl (4R)-4-(2-chlorophenyl)-5-cyano-6-(2-ethoxy-2-oxo-ethyl)sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate CAS Name: (4R)-4-(2-chlorophenyl)-5-cyano-6-[(2-ethoxy-2-oxoethyl)thio]-2-methyl-1,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (4R)-4-(2-chlorophenyl)-5-cyano-6-(2-ethoxy-2-oxoethyl)sulfanyl-2-methyl-1,4-dihydropyridine-3-carboxylate Traditional Name: (4R)-4-(2-chlorophenyl)-5-cyano-6-[(2-ethoxy-2-keto-ethyl)thio]-2-methyl-1,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C21H21ClN2O4S MolecularWeight: 432.92044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C(C(=C(N1)C)C(=O)OCC=C)C2=CC=CC=C2Cl)C#N

Isomeric SMILES

CCOC(=O)CSC1=C([C@@H](C(=C(N1)C)C(=O)OCC=C)C2=CC=CC=C2Cl)C#N

InChI

InChI=1S/C21H21ClN2O4S/c1-4-10-28-21(26)18-13(3)24-20(29-12-17(25)27-5-2)15(11-23)19(18)14-8-6-7-9-16(14)22/h4,6-9,19,24H,1,5,10,12H2,2-3H3/t19-/m0/s1