1-[2-(4-bromophenyl)-3-phenyl-imidazo[2,1-b][1,3]benzothiazol-9-ium-1-yl]ethanone

Systemtic Name: 1-[2-(4-bromophenyl)-3-phenyl-imidazo[2,1-b][1,3]benzothiazol-9-ium-1-yl]ethanone Openeye Name: 1-[2-(4-bromophenyl)-3-phenyl-imidazo[2,1-b][1,3]benzothiazol-9-ium-1-yl]ethanone CAS Name: 1-[2-(4-bromophenyl)-3-phenyl-1-imidazo[2,1-b][1,3]benzothiazol-9-iumyl]ethanone IUPAC Name: 1-[2-(4-bromophenyl)-3-phenylimidazo[2,1-b][1,3]benzothiazol-9-ium-1-yl]ethanone Traditional Name: 1-[2-(4-bromophenyl)-3-phenyl-imidazo[2,1-b][1,3]benzothiazol-9-ium-1-yl]ethanone Formula: C23H16BrN2OS+ MolecularWeight: 448.35494

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C2=[N+]1C3=CC=CC=C3S2)C4=CC=CC=C4)C5=CC=C(C=C5)Br

Isomeric SMILES

CC(=O)C1=C(N(C2=[N+]1C3=CC=CC=C3S2)C4=CC=CC=C4)C5=CC=C(C=C5)Br

InChI

InChI=1S/C23H16BrN2OS/c1-15(27)21-22(16-11-13-17(24)14-12-16)25(18-7-3-2-4-8-18)23-26(21)19-9-5-6-10-20(19)28-23/h2-14H,1H3/q+1