1-(2-methyl-1,3-thiazol-3-ium-3-yl)propan-2-one bromide

Systemtic Name: 1-(2-methyl-1,3-thiazol-3-ium-3-yl)propan-2-one bromide Openeye Name: 1-(2-methylthiazol-3-ium-3-yl)propan-2-one bromide CAS Name: 1-(2-methyl-3-thiazol-3-iumyl)-2-propanone bromide IUPAC Name: 1-(2-methyl-1,3-thiazol-3-ium-3-yl)propan-2-one bromide Traditional Name: 1-(2-methylthiazol-3-ium-3-yl)acetone bromide Formula: C7H10BrNOS MolecularWeight: 236.1294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H10NOS.BrH/c1-6(9)5-8-3-4-10-7(8)2;/h3-4H,5H2,1-2H3;1H/q+1;/p-1