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

Systemtic Name: prop-2-enyl 5-cyano-2-methyl-6-(2-oxidanylidene-2-propoxy-ethyl)sulfanyl-4-phenyl-1,4-dihydropyridine-3-carboxylate Openeye Name: allyl 5-cyano-2-methyl-6-(2-oxo-2-propoxy-ethyl)sulfanyl-4-phenyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-[(2-oxo-2-propoxyethyl)thio]-4-phenyl-1,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 5-cyano-2-methyl-6-(2-oxo-2-propoxyethyl)sulfanyl-4-phenyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-6-[(2-keto-2-propoxy-ethyl)thio]-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C22H24N2O4S MolecularWeight: 412.50196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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