3-[[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]sulfamoyl]benzoate

Systemtic Name: 3-[[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]sulfamoyl]benzoate Openeye Name: 3-[[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]sulfamoyl]benzoate CAS Name: 3-[[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]sulfamoyl]benzoate IUPAC Name: 3-[[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]sulfamoyl]benzoate Traditional Name: 3-[[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]sulfamoyl]benzoate Formula: C17H11F3N3O4S- MolecularWeight: 410.34715

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3C=CC=N3)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3C=CC=N3)C(=O)[O-]

InChI

InChI=1S/C17H12F3N3O4S/c18-17(19,20)12-5-6-15(23-8-2-7-21-23)14(10-12)22-28(26,27)13-4-1-3-11(9-13)16(24)25/h1-10,22H,(H,24,25)/p-1