1,3-dimethyl-5-methylsulfanyl-pyrazole-4-carboxylic acid

Systemtic Name: 1,3-dimethyl-5-methylsulfanyl-pyrazole-4-carboxylic acid Openeye Name: 1,3-dimethyl-5-methylsulfanyl-pyrazole-4-carboxylic acid CAS Name: 1,3-dimethyl-5-(methylthio)-4-pyrazolecarboxylic acid IUPAC Name: 1,3-dimethyl-5-methylsulfanylpyrazole-4-carboxylic acid Traditional Name: 1,3-dimethyl-5-(methylthio)pyrazole-4-carboxylic acid Formula: C7H10N2O2S MolecularWeight: 186.2315

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)O)SC)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)O)SC)C

InChI

InChI=1S/C7H10N2O2S/c1-4-5(7(10)11)6(12-3)9(2)8-4/h1-3H3,(H,10,11)