5-(4-fluorophenyl)-1-(4-methylsulfanylphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 5-(4-fluorophenyl)-1-(4-methylsulfanylphenyl)pyrazole-3-carboxylic acid Openeye Name: 5-(4-fluorophenyl)-1-(4-methylsulfanylphenyl)pyrazole-3-carboxylic acid CAS Name: 5-(4-fluorophenyl)-1-[4-(methylthio)phenyl]-3-pyrazolecarboxylic acid IUPAC Name: 5-(4-fluorophenyl)-1-(4-methylsulfanylphenyl)pyrazole-3-carboxylic acid Traditional Name: 5-(4-fluorophenyl)-1-[4-(methylthio)phenyl]pyrazole-3-carboxylic acid Formula: C17H13FN2O2S MolecularWeight: 328.360723

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2C(=CC(=N2)C(=O)O)C3=CC=C(C=C3)F

Isomeric SMILES

CSC1=CC=C(C=C1)N2C(=CC(=N2)C(=O)O)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H13FN2O2S/c1-23-14-8-6-13(7-9-14)20-16(10-15(19-20)17(21)22)11-2-4-12(18)5-3-11/h2-10H,1H3,(H,21,22)