N-phenethyl-3-[[4-[1-(pyridin-4-ylmethyl)piperidin-4-yl]carbonylpiperazin-1-yl]methyl]benzamide

Systemtic Name: N-phenethyl-3-[[4-[1-(pyridin-4-ylmethyl)piperidin-4-yl]carbonylpiperazin-1-yl]methyl]benzamide Openeye Name: N-phenethyl-3-[[4-[1-(4-pyridylmethyl)piperidine-4-carbonyl]piperazin-1-yl]methyl]benzamide CAS Name: 3-[[4-[oxo-[1-(pyridin-4-ylmethyl)-4-piperidinyl]methyl]-1-piperazinyl]methyl]-N-phenethylbenzamide IUPAC Name: N-phenethyl-3-[[4-[1-(pyridin-4-ylmethyl)piperidine-4-carbonyl]piperazin-1-yl]methyl]benzamide Traditional Name: N-phenethyl-3-[[4-[1-(4-pyridylmethyl)isonipecotoyl]piperazino]methyl]benzamide Formula: C32H39N5O2 MolecularWeight: 525.68436

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)NCCC4=CC=CC=C4)CC5=CC=NC=C5

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)NCCC4=CC=CC=C4)CC5=CC=NC=C5

InChI

InChI=1S/C32H39N5O2/c38-31(34-16-11-26-5-2-1-3-6-26)30-8-4-7-28(23-30)25-36-19-21-37(22-20-36)32(39)29-12-17-35(18-13-29)24-27-9-14-33-15-10-27/h1-10,14-15,23,29H,11-13,16-22,24-25H2,(H,34,38)