N-(2-fluorophenyl)-4-[[(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)carbonylamino]carbamoyl]benzenesulfonamide

Systemtic Name: N-(2-fluorophenyl)-4-[[(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)carbonylamino]carbamoyl]benzenesulfonamide Openeye Name: N-(2-fluorophenyl)-4-[[(3-isopropyl-4-oxo-phthalazine-1-carbonyl)amino]carbamoyl]benzenesulfonamide CAS Name: N-(2-fluorophenyl)-4-[oxo-[[oxo-(4-oxo-3-propan-2-yl-1-phthalazinyl)methyl]hydrazo]methyl]benzenesulfonamide IUPAC Name: N-(2-fluorophenyl)-4-[[(4-oxo-3-propan-2-ylphthalazine-1-carbonyl)amino]carbamoyl]benzenesulfonamide Traditional Name: N-(2-fluorophenyl)-4-[[(3-isopropyl-4-keto-phthalazine-1-carbonyl)amino]carbamoyl]benzenesulfonamide Formula: C25H22FN5O5S MolecularWeight: 523.536083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC=C(C=C3)S(=O)(=O)NC4=CC=CC=C4F

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC=C(C=C3)S(=O)(=O)NC4=CC=CC=C4F

InChI

InChI=1S/C25H22FN5O5S/c1-15(2)31-25(34)19-8-4-3-7-18(19)22(29-31)24(33)28-27-23(32)16-11-13-17(14-12-16)37(35,36)30-21-10-6-5-9-20(21)26/h3-15,30H,1-2H3,(H,27,32)(H,28,33)