5-(1-adamantylcarbamoylamino)-N-(2-methylpropyl)-2-[4-(phenylmethyl)piperidin-1-yl]benzamide

Systemtic Name: 5-(1-adamantylcarbamoylamino)-N-(2-methylpropyl)-2-[4-(phenylmethyl)piperidin-1-yl]benzamide Openeye Name: 5-(1-adamantylcarbamoylamino)-2-(4-benzyl-1-piperidyl)-N-isobutyl-benzamide CAS Name: 5-[[(1-adamantylamino)-oxomethyl]amino]-N-(2-methylpropyl)-2-[4-(phenylmethyl)-1-piperidinyl]benzamide IUPAC Name: 5-(1-adamantylcarbamoylamino)-2-(4-benzylpiperidin-1-yl)-N-(2-methylpropyl)benzamide Traditional Name: 5-(1-adamantylcarbamoylamino)-2-(4-benzylpiperidino)-N-isobutyl-benzamide Formula: C34H46N4O2 MolecularWeight: 542.75464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=C(C=CC(=C1)NC(=O)NC23CC4CC(C2)CC(C4)C3)N5CCC(CC5)CC6=CC=CC=C6

Isomeric SMILES

CC(C)CNC(=O)C1=C(C=CC(=C1)NC(=O)NC23CC4CC(C2)CC(C4)C3)N5CCC(CC5)CC6=CC=CC=C6

InChI

InChI=1S/C34H46N4O2/c1-23(2)22-35-32(39)30-18-29(36-33(40)37-34-19-26-15-27(20-34)17-28(16-26)21-34)8-9-31(30)38-12-10-25(11-13-38)14-24-6-4-3-5-7-24/h3-9,18,23,25-28H,10-17,19-22H2,1-2H3,(H,35,39)(H2,36,37,40)