5-[(4-bromophenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)-2-[4-(phenylmethyl)piperidin-1-yl]benzamide

Systemtic Name: 5-[(4-bromophenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)-2-[4-(phenylmethyl)piperidin-1-yl]benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-5-[(4-bromophenyl)carbamoylamino]-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: 5-[[(4-bromoanilino)-oxomethyl]amino]-N-(2-oxolanylmethyl)-2-[4-(phenylmethyl)-1-piperidinyl]benzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-5-[(4-bromophenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide Traditional Name: 2-(4-benzylpiperidino)-5-[(4-bromophenyl)carbamoylamino]-N-(tetrahydrofurfuryl)benzamide Formula: C31H35BrN4O3 MolecularWeight: 591.5386

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)Br)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)Br)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C31H35BrN4O3/c32-24-8-10-25(11-9-24)34-31(38)35-26-12-13-29(28(20-26)30(37)33-21-27-7-4-18-39-27)36-16-14-23(15-17-36)19-22-5-2-1-3-6-22/h1-3,5-6,8-13,20,23,27H,4,7,14-19,21H2,(H,33,37)(H2,34,35,38)