4-[[4-(2-methyl-1-phenyl-benzimidazol-5-yl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(2-methyl-1-phenyl-benzimidazol-5-yl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(2-methyl-1-phenyl-benzimidazole-5-carbonyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[(2-methyl-1-phenyl-5-benzimidazolyl)-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(2-methyl-1-phenylbenzimidazole-5-carbonyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(2-methyl-1-phenyl-benzimidazole-5-carbonyl)piperazino]methyl]benzonitrile Formula: C27H25N5O MolecularWeight: 435.5203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)C(=O)N4CCN(CC4)CC5=CC=C(C=C5)C#N

Isomeric SMILES

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)C(=O)N4CCN(CC4)CC5=CC=C(C=C5)C#N

InChI

InChI=1S/C27H25N5O/c1-20-29-25-17-23(11-12-26(25)32(20)24-5-3-2-4-6-24)27(33)31-15-13-30(14-16-31)19-22-9-7-21(18-28)8-10-22/h2-12,17H,13-16,19H2,1H3