(2-methyl-1-phenyl-benzimidazol-5-yl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (2-methyl-1-phenyl-benzimidazol-5-yl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (4-benzyl-1,4-diazepan-1-yl)-(2-methyl-1-phenyl-benzimidazol-5-yl)methanone CAS Name: (2-methyl-1-phenyl-5-benzimidazolyl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (4-benzyl-1,4-diazepan-1-yl)-(2-methyl-1-phenylbenzimidazol-5-yl)methanone Traditional Name: (4-benzyl-1,4-diazepan-1-yl)-(2-methyl-1-phenyl-benzimidazol-5-yl)methanone Formula: C27H28N4O MolecularWeight: 424.53742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)C(=O)N4CCCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)C(=O)N4CCCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C27H28N4O/c1-21-28-25-19-23(13-14-26(25)31(21)24-11-6-3-7-12-24)27(32)30-16-8-15-29(17-18-30)20-22-9-4-2-5-10-22/h2-7,9-14,19H,8,15-18,20H2,1H3