1-[(4-bromanylphenoxy)methyl]-N-(3-imidazol-1-ylpropyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanylphenoxy)methyl]-N-(3-imidazol-1-ylpropyl)pyrazole-3-carboxamide Openeye Name: 1-[(4-bromophenoxy)methyl]-N-(3-imidazol-1-ylpropyl)pyrazole-3-carboxamide CAS Name: 1-[(4-bromophenoxy)methyl]-N-[3-(1-imidazolyl)propyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromophenoxy)methyl]-N-(3-imidazol-1-ylpropyl)pyrazole-3-carboxamide Traditional Name: 1-[(4-bromophenoxy)methyl]-N-(3-imidazol-1-ylpropyl)pyrazole-3-carboxamide Formula: C17H18BrN5O2 MolecularWeight: 404.26112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCN2C=CC(=N2)C(=O)NCCCN3C=CN=C3)Br

Isomeric SMILES

C1=CC(=CC=C1OCN2C=CC(=N2)C(=O)NCCCN3C=CN=C3)Br

InChI

InChI=1S/C17H18BrN5O2/c18-14-2-4-15(5-3-14)25-13-23-10-6-16(21-23)17(24)20-7-1-9-22-11-8-19-12-22/h2-6,8,10-12H,1,7,9,13H2,(H,20,24)