3-phenyl-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-N-propan-2-yl-piperidine-1-carboxamide

Systemtic Name: 3-phenyl-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-N-propan-2-yl-piperidine-1-carboxamide Openeye Name: 3-(4-benzylpiperazine-1-carbonyl)-N-isopropyl-5-phenyl-piperidine-1-carboxamide CAS Name: 3-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-5-phenyl-N-propan-2-yl-1-piperidinecarboxamide IUPAC Name: 3-(4-benzylpiperazine-1-carbonyl)-5-phenyl-N-propan-2-ylpiperidine-1-carboxamide Traditional Name: 3-(4-benzylpiperazine-1-carbonyl)-N-isopropyl-5-phenyl-piperidine-1-carboxamide Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)N1CC(CC(C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)NC(=O)N1CC(CC(C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H36N4O2/c1-21(2)28-27(33)31-19-24(23-11-7-4-8-12-23)17-25(20-31)26(32)30-15-13-29(14-16-30)18-22-9-5-3-6-10-22/h3-12,21,24-25H,13-20H2,1-2H3,(H,28,33)