[(1S)-2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] (2R)-1-thiophen-2-ylcarbonylpyrrolidine-2-carboxylate

Systemtic Name: [(1S)-2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] (2R)-1-thiophen-2-ylcarbonylpyrrolidine-2-carboxylate Openeye Name: [(1S)-2-(3,5-dimethylanilino)-2-oxo-1-phenyl-ethyl] (2R)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylate CAS Name: (2R)-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid [(1S)-2-(3,5-dimethylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(3,5-dimethylanilino)-2-oxo-1-phenylethyl] (2R)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylate Traditional Name: (2R)-1-(2-thenoyl)pyrrolidine-2-carboxylic acid [(1S)-2-(3,5-dimethylanilino)-2-keto-1-phenyl-ethyl] ester Formula: C26H26N2O4S MolecularWeight: 462.56064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C3CCCN3C(=O)C4=CC=CS4)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)[C@H](C2=CC=CC=C2)OC(=O)[C@H]3CCCN3C(=O)C4=CC=CS4)C

InChI

InChI=1S/C26H26N2O4S/c1-17-14-18(2)16-20(15-17)27-24(29)23(19-8-4-3-5-9-19)32-26(31)21-10-6-12-28(21)25(30)22-11-7-13-33-22/h3-5,7-9,11,13-16,21,23H,6,10,12H2,1-2H3,(H,27,29)/t21-,23+/m1/s1