N-(4-fluorophenyl)-3-[[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]carbamoyl]benzenesulfonamide

Systemtic Name: N-(4-fluorophenyl)-3-[[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]carbamoyl]benzenesulfonamide Openeye Name: N-(4-fluorophenyl)-3-[[(4-oxo-3H-phthalazine-1-carbonyl)amino]carbamoyl]benzenesulfonamide CAS Name: N-(4-fluorophenyl)-3-[oxo-[[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]hydrazo]methyl]benzenesulfonamide IUPAC Name: N-(4-fluorophenyl)-3-[[(4-oxo-3H-phthalazine-1-carbonyl)amino]carbamoyl]benzenesulfonamide Traditional Name: N-(4-fluorophenyl)-3-[[(4-keto-3H-phthalazine-1-carbonyl)amino]carbamoyl]benzenesulfonamide Formula: C22H16FN5O5S MolecularWeight: 481.456343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C22H16FN5O5S/c23-14-8-10-15(11-9-14)28-34(32,33)16-5-3-4-13(12-16)20(29)25-27-22(31)19-17-6-1-2-7-18(17)21(30)26-24-19/h1-12,28H,(H,25,29)(H,26,30)(H,27,31)