2-[3-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-4-oxidanylidene-phthalazin-1-yl]-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[3-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-4-oxidanylidene-phthalazin-1-yl]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[3-[(4-bromo-2-fluoro-phenyl)methyl]-4-oxo-phthalazin-1-yl]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[3-[(4-bromo-2-fluorophenyl)methyl]-4-oxo-1-phthalazinyl]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[3-[(4-bromo-2-fluorophenyl)methyl]-4-oxophthalazin-1-yl]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[3-(4-bromo-2-fluoro-benzyl)-4-keto-phthalazin-1-yl]-N-(2,6-dimethylphenyl)acetamide Formula: C25H21BrFN3O2 MolecularWeight: 494.355543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CC2=NN(C(=O)C3=CC=CC=C32)CC4=C(C=C(C=C4)Br)F

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CC2=NN(C(=O)C3=CC=CC=C32)CC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C25H21BrFN3O2/c1-15-6-5-7-16(2)24(15)28-23(31)13-22-19-8-3-4-9-20(19)25(32)30(29-22)14-17-10-11-18(26)12-21(17)27/h3-12H,13-14H2,1-2H3,(H,28,31)