2-methyl-4-methylsulfanyl-pyrazole-3-carboxylic acid

Systemtic Name: 2-methyl-4-methylsulfanyl-pyrazole-3-carboxylic acid Openeye Name: 2-methyl-4-methylsulfanyl-pyrazole-3-carboxylic acid CAS Name: 2-methyl-4-(methylthio)-3-pyrazolecarboxylic acid IUPAC Name: 2-methyl-4-methylsulfanylpyrazole-3-carboxylic acid Traditional Name: 2-methyl-4-(methylthio)pyrazole-3-carboxylic acid Formula: C6H8N2O2S MolecularWeight: 172.20492

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)SC)C(=O)O

Isomeric SMILES

CN1C(=C(C=N1)SC)C(=O)O

InChI

InChI=1S/C6H8N2O2S/c1-8-5(6(9)10)4(11-2)3-7-8/h3H,1-2H3,(H,9,10)