2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-6-fluoranyl-benzoic acid

Systemtic Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-6-fluoranyl-benzoic acid Openeye Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-6-fluoro-benzoic acid CAS Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-6-fluorobenzoic acid IUPAC Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-6-fluorobenzoic acid Traditional Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-6-fluoro-benzoic acid Formula: C12H12FN3O4S MolecularWeight: 313.304783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)S(=O)(=O)NC2=C(C(=CC=C2)F)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1)C)S(=O)(=O)NC2=C(C(=CC=C2)F)C(=O)O

InChI

InChI=1S/C12H12FN3O4S/c1-6-11(7(2)15-14-6)21(19,20)16-9-5-3-4-8(13)10(9)12(17)18/h3-5,16H,1-2H3,(H,14,15)(H,17,18)