2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-1-(4-methoxyphenyl)ethanone bromide

Systemtic Name: 2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-1-(4-methoxyphenyl)ethanone bromide Openeye Name: 2-(4,5-dimethylthiazol-3-ium-3-yl)-1-(4-methoxyphenyl)ethanone bromide CAS Name: 2-(4,5-dimethyl-3-thiazol-3-iumyl)-1-(4-methoxyphenyl)ethanone bromide IUPAC Name: 2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-1-(4-methoxyphenyl)ethanone bromide Traditional Name: 2-(4,5-dimethylthiazol-3-ium-3-yl)-1-(4-methoxyphenyl)ethanone bromide Formula: C14H16BrNO2S MolecularWeight: 342.25134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=[N+]1CC(=O)C2=CC=C(C=C2)OC)C.[Br-]

Isomeric SMILES

CC1=C(SC=[N+]1CC(=O)C2=CC=C(C=C2)OC)C.[Br-]

InChI

InChI=1S/C14H16NO2S.BrH/c1-10-11(2)18-9-15(10)8-14(16)12-4-6-13(17-3)7-5-12;/h4-7,9H,8H2,1-3H3;1H/q+1;/p-1