prop-2-enyl 5-cyano-6-[2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-(3-methoxy-4-oxidanyl-phenyl)-2-methyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: prop-2-enyl 5-cyano-6-[2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-(3-methoxy-4-oxidanyl-phenyl)-2-methyl-1,4-dihydropyridine-3-carboxylate Openeye Name: allyl 6-[2-(3-acetylanilino)-2-oxo-ethyl]sulfanyl-5-cyano-4-(4-hydroxy-3-methoxy-phenyl)-2-methyl-1,4-dihydropyridine-3-carboxylate CAS Name: 6-[[2-(3-acetylanilino)-2-oxoethyl]thio]-5-cyano-4-(4-hydroxy-3-methoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 6-[2-(3-acetylanilino)-2-oxoethyl]sulfanyl-5-cyano-4-(4-hydroxy-3-methoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 6-[[2-(3-acetylanilino)-2-keto-ethyl]thio]-5-cyano-4-(4-hydroxy-3-methoxy-phenyl)-2-methyl-1,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C28H27N3O6S MolecularWeight: 533.59548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=CC(=C2)C(=O)C)C#N)C3=CC(=C(C=C3)O)OC)C(=O)OCC=C

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=CC(=C2)C(=O)C)C#N)C3=CC(=C(C=C3)O)OC)C(=O)OCC=C

InChI

InChI=1S/C28H27N3O6S/c1-5-11-37-28(35)25-16(2)30-27(21(14-29)26(25)19-9-10-22(33)23(13-19)36-4)38-15-24(34)31-20-8-6-7-18(12-20)17(3)32/h5-10,12-13,26,30,33H,1,11,15H2,2-4H3,(H,31,34)