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

Systemtic Name: 1-(4-bromophenyl)-2-(4,5-dimethyl-1,3-thiazol-3-ium-2-yl)ethanone Openeye Name: 1-(4-bromophenyl)-2-(4,5-dimethylthiazol-3-ium-2-yl)ethanone CAS Name: 1-(4-bromophenyl)-2-(4,5-dimethyl-2-thiazol-3-iumyl)ethanone IUPAC Name: 1-(4-bromophenyl)-2-(4,5-dimethyl-1,3-thiazol-3-ium-2-yl)ethanone Traditional Name: 1-(4-bromophenyl)-2-(4,5-dimethylthiazol-3-ium-2-yl)ethanone Formula: C13H13BrNOS+ MolecularWeight: 311.21742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=[NH+]1)CC(=O)C2=CC=C(C=C2)Br)C

Isomeric SMILES

CC1=C(SC(=[NH+]1)CC(=O)C2=CC=C(C=C2)Br)C

InChI

InChI=1S/C13H12BrNOS/c1-8-9(2)17-13(15-8)7-12(16)10-3-5-11(14)6-4-10/h3-6H,7H2,1-2H3/p+1