prop-2-enyl (4S)-4-(2-chlorophenyl)-5-cyano-2-methyl-6-(naphthalen-1-ylmethylsulfanyl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: prop-2-enyl (4S)-4-(2-chlorophenyl)-5-cyano-2-methyl-6-(naphthalen-1-ylmethylsulfanyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: allyl (4S)-4-(2-chlorophenyl)-5-cyano-2-methyl-6-(1-naphthylmethylsulfanyl)-1,4-dihydropyridine-3-carboxylate CAS Name: (4S)-4-(2-chlorophenyl)-5-cyano-2-methyl-6-(1-naphthalenylmethylthio)-1,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (4S)-4-(2-chlorophenyl)-5-cyano-2-methyl-6-(naphthalen-1-ylmethylsulfanyl)-1,4-dihydropyridine-3-carboxylate Traditional Name: (4S)-4-(2-chlorophenyl)-5-cyano-2-methyl-6-(1-naphthylmethylthio)-1,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C28H23ClN2O2S MolecularWeight: 487.01242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC2=CC=CC3=CC=CC=C32)C#N)C4=CC=CC=C4Cl)C(=O)OCC=C

Isomeric SMILES

CC1=C([C@@H](C(=C(N1)SCC2=CC=CC3=CC=CC=C32)C#N)C4=CC=CC=C4Cl)C(=O)OCC=C

InChI

InChI=1S/C28H23ClN2O2S/c1-3-15-33-28(32)25-18(2)31-27(23(16-30)26(25)22-13-6-7-14-24(22)29)34-17-20-11-8-10-19-9-4-5-12-21(19)20/h3-14,26,31H,1,15,17H2,2H3/t26-/m1/s1