N-tert-butyl-3-[4-(2-methylphenyl)piperazin-1-yl]carbonyl-4-phenyl-pyrrolidine-1-carboxamide

Systemtic Name: N-tert-butyl-3-[4-(2-methylphenyl)piperazin-1-yl]carbonyl-4-phenyl-pyrrolidine-1-carboxamide Openeye Name: N-tert-butyl-3-[4-(o-tolyl)piperazine-1-carbonyl]-4-phenyl-pyrrolidine-1-carboxamide CAS Name: N-tert-butyl-3-[[4-(2-methylphenyl)-1-piperazinyl]-oxomethyl]-4-phenyl-1-pyrrolidinecarboxamide IUPAC Name: N-tert-butyl-3-[4-(2-methylphenyl)piperazine-1-carbonyl]-4-phenylpyrrolidine-1-carboxamide Traditional Name: N-tert-butyl-3-[4-(o-tolyl)piperazine-1-carbonyl]-4-phenyl-pyrrolidine-1-carboxamide Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3CN(CC3C4=CC=CC=C4)C(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3CN(CC3C4=CC=CC=C4)C(=O)NC(C)(C)C

InChI

InChI=1S/C27H36N4O2/c1-20-10-8-9-13-24(20)29-14-16-30(17-15-29)25(32)23-19-31(26(33)28-27(2,3)4)18-22(23)21-11-6-5-7-12-21/h5-13,22-23H,14-19H2,1-4H3,(H,28,33)