5-[(3-chloranyl-4-fluoranyl-phenyl)sulfonylamino]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[(3-chloranyl-4-fluoranyl-phenyl)sulfonylamino]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-[(3-chloro-4-fluoro-phenyl)sulfonylamino]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-[(3-chloro-4-fluorophenyl)sulfonylamino]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[(3-chloro-4-fluorophenyl)sulfonylamino]-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-[(3-chloro-4-fluoro-phenyl)sulfonylamino]-1-methyl-pyrazole-4-carboxylic acid Formula: C11H9ClFN3O4S MolecularWeight: 333.723263

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CN1C(=C(C=N1)C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C11H9ClFN3O4S/c1-16-10(7(5-14-16)11(17)18)15-21(19,20)6-2-3-9(13)8(12)4-6/h2-5,15H,1H3,(H,17,18)