1-butyl-5-oxidanylidene-N-[4-[4-(phenylmethyl)piperazin-1-yl]carbonylphenyl]pyrrolidine-3-carboxamide

Systemtic Name: 1-butyl-5-oxidanylidene-N-[4-[4-(phenylmethyl)piperazin-1-yl]carbonylphenyl]pyrrolidine-3-carboxamide Openeye Name: N-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-1-butyl-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-butyl-5-oxo-N-[4-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]phenyl]-3-pyrrolidinecarboxamide IUPAC Name: N-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-1-butyl-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[4-(4-benzylpiperazine-1-carbonyl)phenyl]-1-butyl-5-keto-pyrrolidine-3-carboxamide Formula: C27H34N4O3 MolecularWeight: 462.58386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H34N4O3/c1-2-3-13-31-20-23(18-25(31)32)26(33)28-24-11-9-22(10-12-24)27(34)30-16-14-29(15-17-30)19-21-7-5-4-6-8-21/h4-12,23H,2-3,13-20H2,1H3,(H,28,33)