methyl 2-(4-cyanophenyl)-1-[(3-methylphenyl)carbamoyl]-5-piperazin-1-ylcarbonyl-pyrrolidine-3-carboxylate

Systemtic Name: methyl 2-(4-cyanophenyl)-1-[(3-methylphenyl)carbamoyl]-5-piperazin-1-ylcarbonyl-pyrrolidine-3-carboxylate Openeye Name: methyl 2-(4-cyanophenyl)-1-(m-tolylcarbamoyl)-5-(piperazine-1-carbonyl)pyrrolidine-3-carboxylate CAS Name: 2-(4-cyanophenyl)-1-[(3-methylanilino)-oxomethyl]-5-[oxo(1-piperazinyl)methyl]-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-cyanophenyl)-1-[(3-methylphenyl)carbamoyl]-5-(piperazine-1-carbonyl)pyrrolidine-3-carboxylate Traditional Name: 2-(4-cyanophenyl)-1-(m-tolylcarbamoyl)-5-(piperazine-1-carbonyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C26H29N5O4 MolecularWeight: 475.53956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2C(CC(C2C3=CC=C(C=C3)C#N)C(=O)OC)C(=O)N4CCNCC4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2C(CC(C2C3=CC=C(C=C3)C#N)C(=O)OC)C(=O)N4CCNCC4

InChI

InChI=1S/C26H29N5O4/c1-17-4-3-5-20(14-17)29-26(34)31-22(24(32)30-12-10-28-11-13-30)15-21(25(33)35-2)23(31)19-8-6-18(16-27)7-9-19/h3-9,14,21-23,28H,10-13,15H2,1-2H3,(H,29,34)