(2-methylsulfanylphenyl) 1H-pyrazole-5-carboxylate

Systemtic Name: (2-methylsulfanylphenyl) 1H-pyrazole-5-carboxylate Openeye Name: (2-methylsulfanylphenyl) 1H-pyrazole-5-carboxylate CAS Name: 1H-pyrazole-5-carboxylic acid [2-(methylthio)phenyl] ester IUPAC Name: (2-methylsulfanylphenyl) 1H-pyrazole-5-carboxylate Traditional Name: 1H-pyrazole-5-carboxylic acid [2-(methylthio)phenyl] ester Formula: C11H10N2O2S MolecularWeight: 234.2743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1OC(=O)C2=CC=NN2

Isomeric SMILES

CSC1=CC=CC=C1OC(=O)C2=CC=NN2

InChI

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