2-fluoranyl-5-[[(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)carbonylamino]sulfamoyl]benzoic acid

Systemtic Name: 2-fluoranyl-5-[[(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)carbonylamino]sulfamoyl]benzoic acid Openeye Name: 2-fluoro-5-[[(3-isopropyl-4-oxo-phthalazine-1-carbonyl)amino]sulfamoyl]benzoic acid CAS Name: 2-fluoro-5-[[[oxo-(4-oxo-3-propan-2-yl-1-phthalazinyl)methyl]amino]sulfamoyl]benzoic acid IUPAC Name: 2-fluoro-5-[[(4-oxo-3-propan-2-ylphthalazine-1-carbonyl)amino]sulfamoyl]benzoic acid Traditional Name: 2-fluoro-5-[[(3-isopropyl-4-keto-phthalazine-1-carbonyl)amino]sulfamoyl]benzoic acid Formula: C19H17FN4O6S MolecularWeight: 448.424883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNS(=O)(=O)C3=CC(=C(C=C3)F)C(=O)O

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNS(=O)(=O)C3=CC(=C(C=C3)F)C(=O)O

InChI

InChI=1S/C19H17FN4O6S/c1-10(2)24-18(26)13-6-4-3-5-12(13)16(22-24)17(25)21-23-31(29,30)11-7-8-15(20)14(9-11)19(27)28/h3-10,23H,1-2H3,(H,21,25)(H,27,28)