5-[4-(methylsulfonylaminomethyl)phenyl]-1-pyridin-3-yl-pyrazole-3-carboxylic acid

Systemtic Name: 5-[4-(methylsulfonylaminomethyl)phenyl]-1-pyridin-3-yl-pyrazole-3-carboxylic acid Openeye Name: 5-[4-(methanesulfonamidomethyl)phenyl]-1-(3-pyridyl)pyrazole-3-carboxylic acid CAS Name: 5-[4-(methanesulfonamidomethyl)phenyl]-1-(3-pyridinyl)-3-pyrazolecarboxylic acid IUPAC Name: 5-[4-(methanesulfonamidomethyl)phenyl]-1-pyridin-3-ylpyrazole-3-carboxylic acid Traditional Name: 5-[4-(methanesulfonamidomethyl)phenyl]-1-(3-pyridyl)pyrazole-3-carboxylic acid Formula: C17H16N4O4S MolecularWeight: 372.39834

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCC1=CC=C(C=C1)C2=CC(=NN2C3=CN=CC=C3)C(=O)O

Isomeric SMILES

CS(=O)(=O)NCC1=CC=C(C=C1)C2=CC(=NN2C3=CN=CC=C3)C(=O)O

InChI

InChI=1S/C17H16N4O4S/c1-26(24,25)19-10-12-4-6-13(7-5-12)16-9-15(17(22)23)20-21(16)14-3-2-8-18-11-14/h2-9,11,19H,10H2,1H3,(H,22,23)