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

Systemtic Name: 2-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate Openeye Name: 2-[1-(p-tolyl)tetrazol-5-yl]sulfanylacetate CAS Name: 2-[[1-(4-methylphenyl)-5-tetrazolyl]thio]acetate IUPAC Name: 2-[1-(4-methylphenyl)tetrazol-5-yl]sulfanylacetate Traditional Name: 2-[[1-(p-tolyl)tetrazol-5-yl]thio]acetate Formula: C10H9N4O2S- MolecularWeight: 249.26906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)[O-]

InChI

InChI=1S/C10H10N4O2S/c1-7-2-4-8(5-3-7)14-10(11-12-13-14)17-6-9(15)16/h2-5H,6H2,1H3,(H,15,16)/p-1