5-[(4-butylphenyl)carbonylamino]-2-[4-(phenylmethyl)piperidin-1-yl]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 5-[(4-butylphenyl)carbonylamino]-2-[4-(phenylmethyl)piperidin-1-yl]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-5-[(4-butylbenzoyl)amino]-N-(3-pyridylmethyl)benzamide CAS Name: 5-[[(4-butylphenyl)-oxomethyl]amino]-2-[4-(phenylmethyl)-1-piperidinyl]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-5-[(4-butylbenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 2-(4-benzylpiperidino)-5-[(4-butylbenzoyl)amino]-N-(3-pyridylmethyl)benzamide Formula: C36H40N4O2 MolecularWeight: 560.7284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCC(CC3)CC4=CC=CC=C4)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCC(CC3)CC4=CC=CC=C4)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C36H40N4O2/c1-2-3-8-27-12-14-31(15-13-27)35(41)39-32-16-17-34(33(24-32)36(42)38-26-30-11-7-20-37-25-30)40-21-18-29(19-22-40)23-28-9-5-4-6-10-28/h4-7,9-17,20,24-25,29H,2-3,8,18-19,21-23,26H2,1H3,(H,38,42)(H,39,41)