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

Systemtic Name: 2-[[1-(4-bromanyl-2-fluoranyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoate Openeye Name: 2-[1-(4-bromo-2-fluoro-phenyl)tetrazol-5-yl]sulfanylacetate CAS Name: 2-[[1-(4-bromo-2-fluorophenyl)-5-tetrazolyl]thio]acetate IUPAC Name: 2-[1-(4-bromo-2-fluorophenyl)tetrazol-5-yl]sulfanylacetate Traditional Name: 2-[[1-(4-bromo-2-fluoro-phenyl)tetrazol-5-yl]thio]acetate Formula: C9H5BrFN4O2S- MolecularWeight: 332.129003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)F)N2C(=NN=N2)SCC(=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1Br)F)N2C(=NN=N2)SCC(=O)[O-]

InChI

InChI=1S/C9H6BrFN4O2S/c10-5-1-2-7(6(11)3-5)15-9(12-13-14-15)18-4-8(16)17/h1-3H,4H2,(H,16,17)/p-1