methyl 2-(4-cyanophenyl)-5-[(4-methylphenyl)methylcarbamoyl]-4-phenyl-1-thiophen-2-ylcarbonyl-pyrrolidine-3-carboxylate

Systemtic Name: methyl 2-(4-cyanophenyl)-5-[(4-methylphenyl)methylcarbamoyl]-4-phenyl-1-thiophen-2-ylcarbonyl-pyrrolidine-3-carboxylate Openeye Name: methyl 2-(4-cyanophenyl)-4-phenyl-5-(p-tolylmethylcarbamoyl)-1-(thiophene-2-carbonyl)pyrrolidine-3-carboxylate CAS Name: 2-(4-cyanophenyl)-5-[[(4-methylphenyl)methylamino]-oxomethyl]-1-[oxo(thiophen-2-yl)methyl]-4-phenyl-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-cyanophenyl)-5-[(4-methylphenyl)methylcarbamoyl]-4-phenyl-1-(thiophene-2-carbonyl)pyrrolidine-3-carboxylate Traditional Name: 2-(4-cyanophenyl)-5-[(4-methylbenzyl)carbamoyl]-4-phenyl-1-(2-thenoyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C33H29N3O4S MolecularWeight: 563.66606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2C(C(C(N2C(=O)C3=CC=CS3)C4=CC=C(C=C4)C#N)C(=O)OC)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2C(C(C(N2C(=O)C3=CC=CS3)C4=CC=C(C=C4)C#N)C(=O)OC)C5=CC=CC=C5

InChI

InChI=1S/C33H29N3O4S/c1-21-10-12-23(13-11-21)20-35-31(37)30-27(24-7-4-3-5-8-24)28(33(39)40-2)29(25-16-14-22(19-34)15-17-25)36(30)32(38)26-9-6-18-41-26/h3-18,27-30H,20H2,1-2H3,(H,35,37)