N-[cyclopropyl-(4-methylphenyl)methyl]-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-[cyclopropyl-(4-methylphenyl)methyl]-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanamide Openeye Name: 2-(4-benzyl-1,4-diazepan-1-yl)-N-[cyclopropyl(p-tolyl)methyl]acetamide CAS Name: N-[cyclopropyl-(4-methylphenyl)methyl]-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]acetamide IUPAC Name: 2-(4-benzyl-1,4-diazepan-1-yl)-N-[cyclopropyl-(4-methylphenyl)methyl]acetamide Traditional Name: 2-(4-benzyl-1,4-diazepan-1-yl)-N-[cyclopropyl(p-tolyl)methyl]acetamide Formula: C25H33N3O MolecularWeight: 391.54902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2CC2)NC(=O)CN3CCCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(C2CC2)NC(=O)CN3CCCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H33N3O/c1-20-8-10-22(11-9-20)25(23-12-13-23)26-24(29)19-28-15-5-14-27(16-17-28)18-21-6-3-2-4-7-21/h2-4,6-11,23,25H,5,12-19H2,1H3,(H,26,29)