2-(2-methyl-1,3-thiazol-3-ium-3-yl)-1-phenyl-ethanone bromide

Systemtic Name: 2-(2-methyl-1,3-thiazol-3-ium-3-yl)-1-phenyl-ethanone bromide Openeye Name: 2-(2-methylthiazol-3-ium-3-yl)-1-phenyl-ethanone bromide CAS Name: 2-(2-methyl-3-thiazol-3-iumyl)-1-phenylethanone bromide IUPAC Name: 2-(2-methyl-1,3-thiazol-3-ium-3-yl)-1-phenylethanone bromide Traditional Name: 2-(2-methylthiazol-3-ium-3-yl)-1-phenyl-ethanone bromide Formula: C12H12BrNOS MolecularWeight: 298.19878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12NOS.BrH/c1-10-13(7-8-15-10)9-12(14)11-5-3-2-4-6-11;/h2-8H,9H2,1H3;1H/q+1;/p-1