N-[[4-(aminomethyl)phenyl]methyl]-N-butyl-2-(2-cyclohexylethyl)-3H-benzimidazole-5-carboxamide

Systemtic Name: N-[[4-(aminomethyl)phenyl]methyl]-N-butyl-2-(2-cyclohexylethyl)-3H-benzimidazole-5-carboxamide Openeye Name: N-[[4-(aminomethyl)phenyl]methyl]-N-butyl-2-(2-cyclohexylethyl)-3H-benzimidazole-5-carboxamide CAS Name: N-[[4-(aminomethyl)phenyl]methyl]-N-butyl-2-(2-cyclohexylethyl)-3H-benzimidazole-5-carboxamide IUPAC Name: N-[[4-(aminomethyl)phenyl]methyl]-N-butyl-2-(2-cyclohexylethyl)-3H-benzimidazole-5-carboxamide Traditional Name: N-[4-(aminomethyl)benzyl]-N-butyl-2-(2-cyclohexylethyl)-3H-benzimidazole-5-carboxamide Formula: C28H38N4O MolecularWeight: 446.62752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=C(C=C1)CN)C(=O)C2=CC3=C(C=C2)N=C(N3)CCC4CCCCC4

Isomeric SMILES

CCCCN(CC1=CC=C(C=C1)CN)C(=O)C2=CC3=C(C=C2)N=C(N3)CCC4CCCCC4

InChI

InChI=1S/C28H38N4O/c1-2-3-17-32(20-23-11-9-22(19-29)10-12-23)28(33)24-14-15-25-26(18-24)31-27(30-25)16-13-21-7-5-4-6-8-21/h9-12,14-15,18,21H,2-8,13,16-17,19-20,29H2,1H3,(H,30,31)