N'-(4-bromanyl-1-methyl-pyrrol-2-yl)carbonyl-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carbohydrazide

Systemtic Name: N'-(4-bromanyl-1-methyl-pyrrol-2-yl)carbonyl-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carbohydrazide Openeye Name: 3-benzyl-N'-(4-bromo-1-methyl-pyrrole-2-carbonyl)-4-oxo-phthalazine-1-carbohydrazide CAS Name: N'-[(4-bromo-1-methyl-2-pyrrolyl)-oxomethyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarbohydrazide IUPAC Name: 3-benzyl-N'-(4-bromo-1-methylpyrrole-2-carbonyl)-4-oxophthalazine-1-carbohydrazide Traditional Name: 3-benzyl-N'-(4-bromo-1-methyl-pyrrole-2-carbonyl)-4-keto-phthalazine-1-carbohydrazide Formula: C22H18BrN5O3 MolecularWeight: 480.31402

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)Br

Isomeric SMILES

CN1C=C(C=C1C(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)Br

InChI

InChI=1S/C22H18BrN5O3/c1-27-13-15(23)11-18(27)20(29)24-25-21(30)19-16-9-5-6-10-17(16)22(31)28(26-19)12-14-7-3-2-4-8-14/h2-11,13H,12H2,1H3,(H,24,29)(H,25,30)