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

Systemtic Name: 5-[(4-butoxyphenyl)carbonylamino]-2-[4-(phenylmethyl)piperidin-1-yl]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-5-[(4-butoxybenzoyl)amino]-N-(3-pyridylmethyl)benzamide CAS Name: 5-[[(4-butoxyphenyl)-oxomethyl]amino]-2-[4-(phenylmethyl)-1-piperidinyl]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-5-[(4-butoxybenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 2-(4-benzylpiperidino)-5-[(4-butoxybenzoyl)amino]-N-(3-pyridylmethyl)benzamide Formula: C36H40N4O3 MolecularWeight: 576.7278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=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

CCCCOC1=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/C36H40N4O3/c1-2-3-22-43-32-14-11-30(12-15-32)35(41)39-31-13-16-34(33(24-31)36(42)38-26-29-10-7-19-37-25-29)40-20-17-28(18-21-40)23-27-8-5-4-6-9-27/h4-16,19,24-25,28H,2-3,17-18,20-23,26H2,1H3,(H,38,42)(H,39,41)