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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=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

CC(C)(C)C1=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/c1-36(2,3)30-13-11-29(12-14-30)34(41)39-31-15-16-33(32(23-31)35(42)38-25-28-10-7-19-37-24-28)40-20-17-27(18-21-40)22-26-8-5-4-6-9-26/h4-16,19,23-24,27H,17-18,20-22,25H2,1-3H3,(H,38,42)(H,39,41)