[7-(4-bromophenyl)-3,6-dimethyl-imidazo[2,1-b][1,3]thiazol-7-ium-5-yl]-phenyl-methanone bromide

Systemtic Name: [7-(4-bromophenyl)-3,6-dimethyl-imidazo[2,1-b][1,3]thiazol-7-ium-5-yl]-phenyl-methanone bromide Openeye Name: [7-(4-bromophenyl)-3,6-dimethyl-imidazo[2,1-b]thiazol-7-ium-5-yl]-phenyl-methanone bromide CAS Name: [7-(4-bromophenyl)-3,6-dimethyl-5-imidazo[2,1-b]thiazol-7-iumyl]-phenylmethanone bromide IUPAC Name: [7-(4-bromophenyl)-3,6-dimethylimidazo[2,1-b][1,3]thiazol-7-ium-5-yl]-phenylmethanone bromide Traditional Name: [7-(4-bromophenyl)-3,6-dimethyl-imidazo[2,1-b]thiazol-7-ium-5-yl]-phenyl-methanone bromide Formula: C20H16Br2N2OS MolecularWeight: 492.22684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=[N+](C(=C(N12)C(=O)C3=CC=CC=C3)C)C4=CC=C(C=C4)Br.[Br-]

Isomeric SMILES

CC1=CSC2=[N+](C(=C(N12)C(=O)C3=CC=CC=C3)C)C4=CC=C(C=C4)Br.[Br-]

InChI

InChI=1S/C20H16BrN2OS.BrH/c1-13-12-25-20-22(13)18(19(24)15-6-4-3-5-7-15)14(2)23(20)17-10-8-16(21)9-11-17;/h3-12H,1-2H3;1H/q+1;/p-1