1-[4-[methanoyl(methyl)amino]phenyl]-5-(4-methylsulfonylphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 1-[4-[methanoyl(methyl)amino]phenyl]-5-(4-methylsulfonylphenyl)pyrazole-3-carboxylic acid Openeye Name: 1-[4-[formyl(methyl)amino]phenyl]-5-(4-methylsulfonylphenyl)pyrazole-3-carboxylic acid CAS Name: 1-[4-[formyl(methyl)amino]phenyl]-5-(4-methylsulfonylphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-[4-[formyl(methyl)amino]phenyl]-5-(4-methylsulfonylphenyl)pyrazole-3-carboxylic acid Traditional Name: 1-[4-[formyl(methyl)amino]phenyl]-5-(4-mesylphenyl)pyrazole-3-carboxylic acid Formula: C19H17N3O5S MolecularWeight: 399.42038

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Descriptors Computed from Structure

Canonical SMILES:

CN(C=O)C1=CC=C(C=C1)N2C(=CC(=N2)C(=O)O)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CN(C=O)C1=CC=C(C=C1)N2C(=CC(=N2)C(=O)O)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C19H17N3O5S/c1-21(12-23)14-5-7-15(8-6-14)22-18(11-17(20-22)19(24)25)13-3-9-16(10-4-13)28(2,26)27/h3-12H,1-2H3,(H,24,25)