N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(1-oxidanylidenephthalazin-2-yl)ethanamide

Systemtic Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(1-oxidanylidenephthalazin-2-yl)ethanamide Openeye Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(1-oxophthalazin-2-yl)acetamide CAS Name: N-[2-[(4-bromophenyl)methyl]-3-pyrazolyl]-2-(1-oxo-2-phthalazinyl)acetamide IUPAC Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(1-oxophthalazin-2-yl)acetamide Traditional Name: N-[2-(4-bromobenzyl)pyrazol-3-yl]-2-(1-ketophthalazin-2-yl)acetamide Formula: C20H16BrN5O2 MolecularWeight: 438.27734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN(C2=O)CC(=O)NC3=CC=NN3CC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=NN(C2=O)CC(=O)NC3=CC=NN3CC4=CC=C(C=C4)Br

InChI

InChI=1S/C20H16BrN5O2/c21-16-7-5-14(6-8-16)12-25-18(9-10-22-25)24-19(27)13-26-20(28)17-4-2-1-3-15(17)11-23-26/h1-11H,12-13H2,(H,24,27)