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

Systemtic Name: 6-(4-methoxyphenyl)-7-phenyl-imidazo[2,1-b][1,3,4]thiadiazol-7-ium bromide Openeye Name: 6-(4-methoxyphenyl)-7-phenyl-imidazo[2,1-b][1,3,4]thiadiazol-7-ium bromide CAS Name: 6-(4-methoxyphenyl)-7-phenylimidazo[2,1-b][1,3,4]thiadiazol-7-ium bromide IUPAC Name: 6-(4-methoxyphenyl)-7-phenylimidazo[2,1-b][1,3,4]thiadiazol-7-ium bromide Traditional Name: 6-(4-methoxyphenyl)-7-phenyl-imidazo[2,1-b][1,3,4]thiadiazol-7-ium bromide Formula: C17H14BrN3OS MolecularWeight: 388.28156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CN3C(=[N+]2C4=CC=CC=C4)SC=N3.[Br-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=CN3C(=[N+]2C4=CC=CC=C4)SC=N3.[Br-]

InChI

InChI=1S/C17H14N3OS.BrH/c1-21-15-9-7-13(8-10-15)16-11-19-17(22-12-18-19)20(16)14-5-3-2-4-6-14;/h2-12H,1H3;1H/q+1;/p-1