2-[(4-methylpyrazol-1-yl)methylsulfanyl]ethanoate

Systemtic Name: 2-[(4-methylpyrazol-1-yl)methylsulfanyl]ethanoate Openeye Name: 2-[(4-methylpyrazol-1-yl)methylsulfanyl]acetate CAS Name: 2-[(4-methyl-1-pyrazolyl)methylthio]acetate IUPAC Name: 2-[(4-methylpyrazol-1-yl)methylsulfanyl]acetate Traditional Name: 2-[(4-methylpyrazol-1-yl)methylthio]acetate Formula: C7H9N2O2S- MolecularWeight: 185.22356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(N=C1)CSCC(=O)[O-]

Isomeric SMILES

CC1=CN(N=C1)CSCC(=O)[O-]

InChI

InChI=1S/C7H10N2O2S/c1-6-2-8-9(3-6)5-12-4-7(10)11/h2-3H,4-5H2,1H3,(H,10,11)/p-1