2-fluoranyl-5-[[(3-phenyl-1H-pyrazol-5-yl)carbonylamino]sulfamoyl]benzoic acid

Systemtic Name: 2-fluoranyl-5-[[(3-phenyl-1H-pyrazol-5-yl)carbonylamino]sulfamoyl]benzoic acid Openeye Name: 2-fluoro-5-[[(3-phenyl-1H-pyrazole-5-carbonyl)amino]sulfamoyl]benzoic acid CAS Name: 2-fluoro-5-[[[oxo-(3-phenyl-1H-pyrazol-5-yl)methyl]amino]sulfamoyl]benzoic acid IUPAC Name: 2-fluoro-5-[[(3-phenyl-1H-pyrazole-5-carbonyl)amino]sulfamoyl]benzoic acid Traditional Name: 2-fluoro-5-[[(3-phenyl-1H-pyrazole-5-carbonyl)amino]sulfamoyl]benzoic acid Formula: C17H13FN4O5S MolecularWeight: 404.372323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=C2)C(=O)NNS(=O)(=O)C3=CC(=C(C=C3)F)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=C2)C(=O)NNS(=O)(=O)C3=CC(=C(C=C3)F)C(=O)O

InChI

InChI=1S/C17H13FN4O5S/c18-13-7-6-11(8-12(13)17(24)25)28(26,27)22-21-16(23)15-9-14(19-20-15)10-4-2-1-3-5-10/h1-9,22H,(H,19,20)(H,21,23)(H,24,25)