5-methyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]benzoic acid

Systemtic Name: 5-methyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]benzoic acid Openeye Name: 5-methyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]benzoic acid CAS Name: 5-methyl-2-[(1-methyl-4-pyrazolyl)sulfonylamino]benzoic acid IUPAC Name: 5-methyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]benzoic acid Traditional Name: 5-methyl-2-[(1-methylpyrazol-4-yl)sulfonylamino]benzoic acid Formula: C12H13N3O4S MolecularWeight: 295.31432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CN(N=C2)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CN(N=C2)C)C(=O)O

InChI

InChI=1S/C12H13N3O4S/c1-8-3-4-11(10(5-8)12(16)17)14-20(18,19)9-6-13-15(2)7-9/h3-7,14H,1-2H3,(H,16,17)