5-(3-methylbutanoylamino)-N-phenethyl-2-[4-(phenylmethyl)piperidin-1-yl]benzamide

Systemtic Name: 5-(3-methylbutanoylamino)-N-phenethyl-2-[4-(phenylmethyl)piperidin-1-yl]benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-5-(3-methylbutanoylamino)-N-phenethyl-benzamide CAS Name: 5-[(3-methyl-1-oxobutyl)amino]-N-phenethyl-2-[4-(phenylmethyl)-1-piperidinyl]benzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-5-(3-methylbutanoylamino)-N-phenethylbenzamide Traditional Name: 2-(4-benzylpiperidino)-5-(isovalerylamino)-N-phenethyl-benzamide Formula: C32H39N3O2 MolecularWeight: 497.67096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC(C)CC(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C32H39N3O2/c1-24(2)21-31(36)34-28-13-14-30(29(23-28)32(37)33-18-15-25-9-5-3-6-10-25)35-19-16-27(17-20-35)22-26-11-7-4-8-12-26/h3-14,23-24,27H,15-22H2,1-2H3,(H,33,37)(H,34,36)