2-[(4-ethoxyphenyl)methyl]-N,N-diethyl-1-(3-imidazol-1-ylpropyl)benzimidazole-5-carboxamide

Systemtic Name: 2-[(4-ethoxyphenyl)methyl]-N,N-diethyl-1-(3-imidazol-1-ylpropyl)benzimidazole-5-carboxamide Openeye Name: 2-[(4-ethoxyphenyl)methyl]-N,N-diethyl-1-(3-imidazol-1-ylpropyl)benzimidazole-5-carboxamide CAS Name: 2-[(4-ethoxyphenyl)methyl]-N,N-diethyl-1-[3-(1-imidazolyl)propyl]-5-benzimidazolecarboxamide IUPAC Name: 2-[(4-ethoxyphenyl)methyl]-N,N-diethyl-1-(3-imidazol-1-ylpropyl)benzimidazole-5-carboxamide Traditional Name: 2-(4-ethoxybenzyl)-N,N-diethyl-1-(3-imidazol-1-ylpropyl)benzimidazole-5-carboxamide Formula: C27H33N5O2 MolecularWeight: 459.58322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC2=C(C=C1)N(C(=N2)CC3=CC=C(C=C3)OCC)CCCN4C=CN=C4

Isomeric SMILES

CCN(CC)C(=O)C1=CC2=C(C=C1)N(C(=N2)CC3=CC=C(C=C3)OCC)CCCN4C=CN=C4

InChI

InChI=1S/C27H33N5O2/c1-4-31(5-2)27(33)22-10-13-25-24(19-22)29-26(18-21-8-11-23(12-9-21)34-6-3)32(25)16-7-15-30-17-14-28-20-30/h8-14,17,19-20H,4-7,15-16,18H2,1-3H3