2-(2-azanyl-6-phenyl-imidazo[2,1-b][1,3,4]thiadiazol-7-ium-7-yl)-1-phenyl-ethanone bromide

Systemtic Name: 2-(2-azanyl-6-phenyl-imidazo[2,1-b][1,3,4]thiadiazol-7-ium-7-yl)-1-phenyl-ethanone bromide Openeye Name: 2-(2-amino-6-phenyl-imidazo[2,1-b][1,3,4]thiadiazol-7-ium-7-yl)-1-phenyl-ethanone bromide CAS Name: 2-(2-amino-6-phenyl-7-imidazo[2,1-b][1,3,4]thiadiazol-7-iumyl)-1-phenylethanone bromide IUPAC Name: 2-(2-amino-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-7-ium-7-yl)-1-phenylethanone bromide Traditional Name: 2-(2-amino-6-phenyl-imidazo[2,1-b][1,3,4]thiadiazol-7-ium-7-yl)-1-phenyl-ethanone bromide Formula: C18H15BrN4OS MolecularWeight: 415.3069

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN3C(=[N+]2CC(=O)C4=CC=CC=C4)SC(=N3)N.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CN3C(=[N+]2CC(=O)C4=CC=CC=C4)SC(=N3)N.[Br-]

InChI

InChI=1S/C18H15N4OS.BrH/c19-17-20-22-11-15(13-7-3-1-4-8-13)21(18(22)24-17)12-16(23)14-9-5-2-6-10-14;/h1-11H,12H2,(H2,19,20);1H/q+1;/p-1