[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl (3S)-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxylate

Systemtic Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl (3S)-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxylate Openeye Name: [2-(p-tolyl)thiazol-4-yl]methyl (3S)-5-oxo-1-phenethyl-pyrrolidine-3-carboxylate CAS Name: (3S)-5-oxo-1-phenethyl-3-pyrrolidinecarboxylic acid [2-(4-methylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl (3S)-5-oxo-1-phenethylpyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-phenethyl-pyrrolidine-3-carboxylic acid [2-(p-tolyl)thiazol-4-yl]methyl ester Formula: C24H24N2O3S MolecularWeight: 420.52396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3CC(=O)N(C3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)[C@H]3CC(=O)N(C3)CCC4=CC=CC=C4

InChI

InChI=1S/C24H24N2O3S/c1-17-7-9-19(10-8-17)23-25-21(16-30-23)15-29-24(28)20-13-22(27)26(14-20)12-11-18-5-3-2-4-6-18/h2-10,16,20H,11-15H2,1H3/t20-/m0/s1