4-(2-hydroxyethyl)-1-(2-methylsulfanylphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 4-(2-hydroxyethyl)-1-(2-methylsulfanylphenyl)pyrazole-3-carboxylic acid Openeye Name: 4-(2-hydroxyethyl)-1-(2-methylsulfanylphenyl)pyrazole-3-carboxylic acid CAS Name: 4-(2-hydroxyethyl)-1-[2-(methylthio)phenyl]-3-pyrazolecarboxylic acid IUPAC Name: 4-(2-hydroxyethyl)-1-(2-methylsulfanylphenyl)pyrazole-3-carboxylic acid Traditional Name: 4-(2-hydroxyethyl)-1-[2-(methylthio)phenyl]pyrazole-3-carboxylic acid Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1N2C=C(C(=N2)C(=O)O)CCO

Isomeric SMILES

CSC1=CC=CC=C1N2C=C(C(=N2)C(=O)O)CCO

InChI

InChI=1S/C13H14N2O3S/c1-19-11-5-3-2-4-10(11)15-8-9(6-7-16)12(14-15)13(17)18/h2-5,8,16H,6-7H2,1H3,(H,17,18)