5-(ethylsulfanylmethyl)-1H-pyrazole-3-carboxylic acid

Systemtic Name: 5-(ethylsulfanylmethyl)-1H-pyrazole-3-carboxylic acid Openeye Name: 5-(ethylsulfanylmethyl)-1H-pyrazole-3-carboxylic acid CAS Name: 5-[(ethylthio)methyl]-1H-pyrazole-3-carboxylic acid IUPAC Name: 5-(ethylsulfanylmethyl)-1H-pyrazole-3-carboxylic acid Traditional Name: 5-[(ethylthio)methyl]-1H-pyrazole-3-carboxylic acid Formula: C7H10N2O2S MolecularWeight: 186.2315

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC1=CC(=NN1)C(=O)O

Isomeric SMILES

CCSCC1=CC(=NN1)C(=O)O

InChI

InChI=1S/C7H10N2O2S/c1-2-12-4-5-3-6(7(10)11)9-8-5/h3H,2,4H2,1H3,(H,8,9)(H,10,11)