1-phenyl-2-pyrylium-4-ylsulfanyl-ethanone bromide

Systemtic Name: 1-phenyl-2-pyrylium-4-ylsulfanyl-ethanone bromide Openeye Name: 1-phenyl-2-pyrylium-4-ylsulfanyl-ethanone bromide CAS Name: 1-phenyl-2-(4-pyryliumylthio)ethanone bromide IUPAC Name: 1-phenyl-2-pyrylium-4-ylsulfanylethanone bromide Traditional Name: 1-phenyl-2-(pyrylium-4-ylthio)ethanone bromide Formula: C13H11BrO2S MolecularWeight: 311.19424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11O2S.BrH/c14-13(11-4-2-1-3-5-11)10-16-12-6-8-15-9-7-12;/h1-9H,10H2;1H/q+1;/p-1