3-(3-azanyl-5-methyl-pyrazol-1-yl)sulfonyl-4-fluoranyl-benzoic acid

Systemtic Name: 3-(3-azanyl-5-methyl-pyrazol-1-yl)sulfonyl-4-fluoranyl-benzoic acid Openeye Name: 3-(3-amino-5-methyl-pyrazol-1-yl)sulfonyl-4-fluoro-benzoic acid CAS Name: 3-[(3-amino-5-methyl-1-pyrazolyl)sulfonyl]-4-fluorobenzoic acid IUPAC Name: 3-(3-amino-5-methylpyrazol-1-yl)sulfonyl-4-fluorobenzoic acid Traditional Name: 3-(3-amino-5-methyl-pyrazol-1-yl)sulfonyl-4-fluoro-benzoic acid Formula: C11H10FN3O4S MolecularWeight: 299.278203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)F)N

Isomeric SMILES

CC1=CC(=NN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)F)N

InChI

InChI=1S/C11H10FN3O4S/c1-6-4-10(13)14-15(6)20(18,19)9-5-7(11(16)17)2-3-8(9)12/h2-5H,1H3,(H2,13,14)(H,16,17)