1-[(2-fluorophenyl)methyl]-N-(3-imidazol-1-yl-1-phenyl-propyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[(2-fluorophenyl)methyl]-N-(3-imidazol-1-yl-1-phenyl-propyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-[(2-fluorophenyl)methyl]-N-(3-imidazol-1-yl-1-phenyl-propyl)triazole-4-carboxamide CAS Name: 1-[(2-fluorophenyl)methyl]-N-[3-(1-imidazolyl)-1-phenylpropyl]-4-triazolecarboxamide IUPAC Name: 1-[(2-fluorophenyl)methyl]-N-(3-imidazol-1-yl-1-phenylpropyl)triazole-4-carboxamide Traditional Name: 1-(2-fluorobenzyl)-N-(3-imidazol-1-yl-1-phenyl-propyl)triazole-4-carboxamide Formula: C22H21FN6O MolecularWeight: 404.440143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCN2C=CN=C2)NC(=O)C3=CN(N=N3)CC4=CC=CC=C4F

Isomeric SMILES

C1=CC=C(C=C1)C(CCN2C=CN=C2)NC(=O)C3=CN(N=N3)CC4=CC=CC=C4F

InChI

InChI=1S/C22H21FN6O/c23-19-9-5-4-8-18(19)14-29-15-21(26-27-29)22(30)25-20(17-6-2-1-3-7-17)10-12-28-13-11-24-16-28/h1-9,11,13,15-16,20H,10,12,14H2,(H,25,30)