2-[[1-(3-chloranyl-4-methyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[1-(3-chloranyl-4-methyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate Openeye Name: 2-[1-(3-chloro-4-methyl-phenyl)tetrazol-5-yl]sulfanylacetate CAS Name: 2-[[1-(3-chloro-4-methylphenyl)-5-tetrazolyl]thio]acetate IUPAC Name: 2-[1-(3-chloro-4-methylphenyl)tetrazol-5-yl]sulfanylacetate Traditional Name: 2-[[1-(3-chloro-4-methyl-phenyl)tetrazol-5-yl]thio]acetate Formula: C10H8ClN4O2S- MolecularWeight: 283.71412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9ClN4O2S/c1-6-2-3-7(4-8(6)11)15-10(12-13-14-15)18-5-9(16)17/h2-4H,5H2,1H3,(H,16,17)/p-1