3-methylsulfanyl-1-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-methylsulfanyl-1-phenyl-pyrazole-4-carboxylic acid Openeye Name: 3-methylsulfanyl-1-phenyl-pyrazole-4-carboxylic acid CAS Name: 3-(methylthio)-1-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 3-methylsulfanyl-1-phenylpyrazole-4-carboxylic acid Traditional Name: 3-(methylthio)-1-phenyl-pyrazole-4-carboxylic acid Formula: C11H10N2O2S MolecularWeight: 234.2743

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C=C1C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CSC1=NN(C=C1C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C11H10N2O2S/c1-16-10-9(11(14)15)7-13(12-10)8-5-3-2-4-6-8/h2-7H,1H3,(H,14,15)