2-(2-azanyl-1,3,4-thiadiazol-3-ium-3-yl)-1-phenyl-ethanone bromide

Systemtic Name: 2-(2-azanyl-1,3,4-thiadiazol-3-ium-3-yl)-1-phenyl-ethanone bromide Openeye Name: 2-(2-amino-1,3,4-thiadiazol-3-ium-3-yl)-1-phenyl-ethanone bromide CAS Name: 2-(2-amino-1,3,4-thiadiazol-3-ium-3-yl)-1-phenylethanone bromide IUPAC Name: 2-(2-amino-1,3,4-thiadiazol-3-ium-3-yl)-1-phenylethanone bromide Traditional Name: 2-(2-amino-1,3,4-thiadiazol-3-ium-3-yl)-1-phenyl-ethanone bromide Formula: C10H10BrN3OS MolecularWeight: 300.1749

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C[N+]2=C(SC=N2)N.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C[N+]2=C(SC=N2)N.[Br-]

InChI

InChI=1S/C10H9N3OS.BrH/c11-10-13(12-7-15-10)6-9(14)8-4-2-1-3-5-8;/h1-5,7,11H,6H2;1H