N-(1H-benzimidazol-2-ylmethyl)-N-[(2-fluorophenyl)methyl]-3-imidazol-1-yl-propan-1-amine

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-N-[(2-fluorophenyl)methyl]-3-imidazol-1-yl-propan-1-amine Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-N-[(2-fluorophenyl)methyl]-3-imidazol-1-yl-propan-1-amine CAS Name: N-(1H-benzimidazol-2-ylmethyl)-N-[(2-fluorophenyl)methyl]-3-(1-imidazolyl)-1-propanamine IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-N-[(2-fluorophenyl)methyl]-3-imidazol-1-ylpropan-1-amine Traditional Name: 1H-benzimidazol-2-ylmethyl-(2-fluorobenzyl)-(3-imidazol-1-ylpropyl)amine Formula: C21H22FN5 MolecularWeight: 363.431283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN(CCCN2C=CN=C2)CC3=NC4=CC=CC=C4N3)F

Isomeric SMILES

C1=CC=C(C(=C1)CN(CCCN2C=CN=C2)CC3=NC4=CC=CC=C4N3)F

InChI

InChI=1S/C21H22FN5/c22-18-7-2-1-6-17(18)14-27(12-5-11-26-13-10-23-16-26)15-21-24-19-8-3-4-9-20(19)25-21/h1-4,6-10,13,16H,5,11-12,14-15H2,(H,24,25)