2-(2,6-dimethylpyrylium-4-yl)sulfanyl-1-(4-methylphenyl)ethanone bromide

Systemtic Name: 2-(2,6-dimethylpyrylium-4-yl)sulfanyl-1-(4-methylphenyl)ethanone bromide Openeye Name: 2-(2,6-dimethylpyrylium-4-yl)sulfanyl-1-(p-tolyl)ethanone bromide CAS Name: 2-[(2,6-dimethyl-4-pyryliumyl)thio]-1-(4-methylphenyl)ethanone bromide IUPAC Name: 2-(2,6-dimethylpyrylium-4-yl)sulfanyl-1-(4-methylphenyl)ethanone bromide Traditional Name: 2-[(2,6-dimethylpyrylium-4-yl)thio]-1-(p-tolyl)ethanone bromide Formula: C16H17BrO2S MolecularWeight: 353.27398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=CC(=[O+]C(=C2)C)C.[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=CC(=[O+]C(=C2)C)C.[Br-]

InChI

InChI=1S/C16H17O2S.BrH/c1-11-4-6-14(7-5-11)16(17)10-19-15-8-12(2)18-13(3)9-15;/h4-9H,10H2,1-3H3;1H/q+1;/p-1