prop-2-enyl (4S)-5-cyano-6-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-2-methyl-4-phenyl-3,4-dihydropyridine-3-carboxylate

Systemtic Name: prop-2-enyl (4S)-5-cyano-6-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-2-methyl-4-phenyl-3,4-dihydropyridine-3-carboxylate Openeye Name: allyl (4S)-5-cyano-6-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-2-methyl-4-phenyl-3,4-dihydropyridine-3-carboxylate CAS Name: (4S)-5-cyano-6-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-2-methyl-4-phenyl-3,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (4S)-5-cyano-6-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-2-methyl-4-phenyl-3,4-dihydropyridine-3-carboxylate Traditional Name: (4S)-5-cyano-6-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-2-methyl-4-phenyl-3,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C26H24N2O4S MolecularWeight: 460.54476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)OCC=C)C2=CC=CC=C2)C#N)SCC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)OCC=C)C2=CC=CC=C2)C#N)SCC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C26H24N2O4S/c1-4-14-32-26(30)23-17(2)28-25(21(15-27)24(23)19-8-6-5-7-9-19)33-16-22(29)18-10-12-20(31-3)13-11-18/h4-13,23-24H,1,14,16H2,2-3H3/t23?,24-/m0/s1