N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-1-[(4-fluoranylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-1-[(4-fluoranylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-[(4-fluorophenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-1-[(4-fluorophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-[(4-fluorophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-[(4-fluorophenoxy)methyl]pyrazole-3-carboxamide Formula: C21H17BrFN5O2 MolecularWeight: 470.294383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)F)CN4C=C(C=N4)Br

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)F)CN4C=C(C=N4)Br

InChI

InChI=1S/C21H17BrFN5O2/c22-16-11-24-28(13-16)12-15-2-1-3-18(10-15)25-21(29)20-8-9-27(26-20)14-30-19-6-4-17(23)5-7-19/h1-11,13H,12,14H2,(H,25,29)