2-bromanyl-5-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfamoyl]benzoic acid

Systemtic Name: 2-bromanyl-5-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfamoyl]benzoic acid Openeye Name: 2-bromo-5-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfamoyl]benzoic acid CAS Name: 2-bromo-5-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfamoyl]benzoic acid IUPAC Name: 2-bromo-5-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfamoyl]benzoic acid Traditional Name: 2-bromo-5-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfamoyl]benzoic acid Formula: C12H12BrN3O4S MolecularWeight: 374.21038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)NS(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1)C)NS(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C12H12BrN3O4S/c1-6-11(7(2)15-14-6)16-21(19,20)8-3-4-10(13)9(5-8)12(17)18/h3-5,16H,1-2H3,(H,14,15)(H,17,18)