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

Systemtic Name: prop-2-enyl 5-cyano-6-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate Openeye Name: allyl 5-cyano-6-(2-ethoxy-2-oxo-ethyl)sulfanyl-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-6-[(2-ethoxy-2-oxoethyl)thio]-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 5-cyano-6-(2-ethoxy-2-oxoethyl)sulfanyl-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-6-[(2-ethoxy-2-keto-ethyl)thio]-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O4S/c1-4-11-27-21(25)18-14(3)23-20(28-13-17(24)26-5-2)16(12-22)19(18)15-9-7-6-8-10-15/h4,6-10,19,23H,1,5,11,13H2,2-3H3