4-bromanyl-3-phenyl-1,2,3-oxadiazol-3-ium-5-thiolate

Systemtic Name: 4-bromanyl-3-phenyl-1,2,3-oxadiazol-3-ium-5-thiolate Openeye Name: 4-bromo-3-phenyl-oxadiazol-3-ium-5-thiolate CAS Name: 4-bromo-3-phenyl-5-oxadiazol-3-iumthiolate IUPAC Name: 4-bromo-3-phenyloxadiazol-3-ium-5-thiolate Traditional Name: 4-bromo-3-phenyl-oxadiazol-3-ium-5-thiolate Formula: C8H5BrN2OS MolecularWeight: 257.1071

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2=NOC(=C2Br)[S-]

Isomeric SMILES

C1=CC=C(C=C1)[N+]2=NOC(=C2Br)[S-]

InChI

InChI=1S/C8H5BrN2OS/c9-7-8(13)12-10-11(7)6-4-2-1-3-5-6/h1-5H