(2-fluorophenyl)methyl 3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)sulfamoyl]benzoate

Systemtic Name: (2-fluorophenyl)methyl 3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)sulfamoyl]benzoate Openeye Name: (2-fluorophenyl)methyl 3-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)sulfamoyl]benzoate CAS Name: 3-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)sulfamoyl]benzoic acid (2-fluorophenyl)methyl ester IUPAC Name: (2-fluorophenyl)methyl 3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)sulfamoyl]benzoate Traditional Name: 3-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)sulfamoyl]benzoic acid (2-fluorobenzyl) ester Formula: C25H22FN3O5S MolecularWeight: 495.522683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)OCC4=CC=CC=C4F

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)OCC4=CC=CC=C4F

InChI

InChI=1S/C25H22FN3O5S/c1-17-23(24(30)29(28(17)2)20-11-4-3-5-12-20)27-35(32,33)21-13-8-10-18(15-21)25(31)34-16-19-9-6-7-14-22(19)26/h3-15,27H,16H2,1-2H3