1-(4-bromophenyl)-2-(5-methyl-1,3-thiazol-3-ium-3-yl)ethanone bromide

Systemtic Name: 1-(4-bromophenyl)-2-(5-methyl-1,3-thiazol-3-ium-3-yl)ethanone bromide Openeye Name: 1-(4-bromophenyl)-2-(5-methylthiazol-3-ium-3-yl)ethanone bromide CAS Name: 1-(4-bromophenyl)-2-(5-methyl-3-thiazol-3-iumyl)ethanone bromide IUPAC Name: 1-(4-bromophenyl)-2-(5-methyl-1,3-thiazol-3-ium-3-yl)ethanone bromide Traditional Name: 1-(4-bromophenyl)-2-(5-methylthiazol-3-ium-3-yl)ethanone bromide Formula: C12H11Br2NOS MolecularWeight: 377.09484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CS1)CC(=O)C2=CC=C(C=C2)Br.[Br-]

Isomeric SMILES

CC1=C[N+](=CS1)CC(=O)C2=CC=C(C=C2)Br.[Br-]

InChI

InChI=1S/C12H11BrNOS.BrH/c1-9-6-14(8-16-9)7-12(15)10-2-4-11(13)5-3-10;/h2-6,8H,7H2,1H3;1H/q+1;/p-1