2-methyl-4-(4-methylsulfonylphenyl)-5-pyridin-4-yl-pyrazole-3-carboxylic acid

Systemtic Name: 2-methyl-4-(4-methylsulfonylphenyl)-5-pyridin-4-yl-pyrazole-3-carboxylic acid Openeye Name: 2-methyl-4-(4-methylsulfonylphenyl)-5-(4-pyridyl)pyrazole-3-carboxylic acid CAS Name: 2-methyl-4-(4-methylsulfonylphenyl)-5-pyridin-4-yl-3-pyrazolecarboxylic acid IUPAC Name: 2-methyl-4-(4-methylsulfonylphenyl)-5-pyridin-4-ylpyrazole-3-carboxylic acid Traditional Name: 4-(4-mesylphenyl)-2-methyl-5-(4-pyridyl)pyrazole-3-carboxylic acid Formula: C17H15N3O4S MolecularWeight: 357.3837

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C2=CC=NC=C2)C3=CC=C(C=C3)S(=O)(=O)C)C(=O)O

Isomeric SMILES

CN1C(=C(C(=N1)C2=CC=NC=C2)C3=CC=C(C=C3)S(=O)(=O)C)C(=O)O

InChI

InChI=1S/C17H15N3O4S/c1-20-16(17(21)22)14(15(19-20)12-7-9-18-10-8-12)11-3-5-13(6-4-11)25(2,23)24/h3-10H,1-2H3,(H,21,22)