2-[[1-(3-methylsulfanylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[1-(3-methylsulfanylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate Openeye Name: 2-[1-(3-methylsulfanylphenyl)tetrazol-5-yl]sulfanylacetate CAS Name: 2-[[1-[3-(methylthio)phenyl]-5-tetrazolyl]thio]acetate IUPAC Name: 2-[1-(3-methylsulfanylphenyl)tetrazol-5-yl]sulfanylacetate Traditional Name: 2-[[1-[3-(methylthio)phenyl]tetrazol-5-yl]thio]acetate Formula: C10H9N4O2S2- MolecularWeight: 281.33406

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)N2C(=NN=N2)SCC(=O)[O-]

Isomeric SMILES

CSC1=CC=CC(=C1)N2C(=NN=N2)SCC(=O)[O-]

InChI

InChI=1S/C10H10N4O2S2/c1-17-8-4-2-3-7(5-8)14-10(11-12-13-14)18-6-9(15)16/h2-5H,6H2,1H3,(H,15,16)/p-1