4-methyl-3-[(1-methylpyrazol-4-yl)sulfonylamino]benzoic acid

Systemtic Name: 4-methyl-3-[(1-methylpyrazol-4-yl)sulfonylamino]benzoic acid Openeye Name: 4-methyl-3-[(1-methylpyrazol-4-yl)sulfonylamino]benzoic acid CAS Name: 4-methyl-3-[(1-methyl-4-pyrazolyl)sulfonylamino]benzoic acid IUPAC Name: 4-methyl-3-[(1-methylpyrazol-4-yl)sulfonylamino]benzoic acid Traditional Name: 4-methyl-3-[(1-methylpyrazol-4-yl)sulfonylamino]benzoic acid Formula: C12H13N3O4S MolecularWeight: 295.31432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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