2-[3-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-4-oxidanylidene-phthalazin-1-yl]-N-pyridin-2-yl-ethanamide

Systemtic Name: 2-[3-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-4-oxidanylidene-phthalazin-1-yl]-N-pyridin-2-yl-ethanamide Openeye Name: 2-[3-[(4-bromo-2-fluoro-phenyl)methyl]-4-oxo-phthalazin-1-yl]-N-(2-pyridyl)acetamide CAS Name: 2-[3-[(4-bromo-2-fluorophenyl)methyl]-4-oxo-1-phthalazinyl]-N-(2-pyridinyl)acetamide IUPAC Name: 2-[3-[(4-bromo-2-fluorophenyl)methyl]-4-oxophthalazin-1-yl]-N-pyridin-2-ylacetamide Traditional Name: 2-[3-(4-bromo-2-fluoro-benzyl)-4-keto-phthalazin-1-yl]-N-(2-pyridyl)acetamide Formula: C22H16BrFN4O2 MolecularWeight: 467.290443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=C(C=C(C=C3)Br)F)CC(=O)NC4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=C(C=C(C=C3)Br)F)CC(=O)NC4=CC=CC=N4

InChI

InChI=1S/C22H16BrFN4O2/c23-15-9-8-14(18(24)11-15)13-28-22(30)17-6-2-1-5-16(17)19(27-28)12-21(29)26-20-7-3-4-10-25-20/h1-11H,12-13H2,(H,25,26,29)