1-(3,4-dichlorophenyl)-2-(4,5-dihydro-1H-imidazol-1-ium-2-ylsulfanyl)ethanone bromide

Systemtic Name: 1-(3,4-dichlorophenyl)-2-(4,5-dihydro-1H-imidazol-1-ium-2-ylsulfanyl)ethanone bromide Openeye Name: 1-(3,4-dichlorophenyl)-2-(4,5-dihydro-1H-imidazol-1-ium-2-ylsulfanyl)ethanone bromide CAS Name: 1-(3,4-dichlorophenyl)-2-(4,5-dihydro-1H-imidazol-1-ium-2-ylthio)ethanone bromide IUPAC Name: 1-(3,4-dichlorophenyl)-2-(4,5-dihydro-1H-imidazol-1-ium-2-ylsulfanyl)ethanone bromide Traditional Name: 1-(3,4-dichlorophenyl)-2-(2-imidazolin-1-ium-2-ylthio)ethanone bromide Formula: C11H11BrCl2N2OS MolecularWeight: 370.09284

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C([NH2+]1)SCC(=O)C2=CC(=C(C=C2)Cl)Cl.[Br-]

Isomeric SMILES

C1CN=C([NH2+]1)SCC(=O)C2=CC(=C(C=C2)Cl)Cl.[Br-]

InChI

InChI=1S/C11H10Cl2N2OS.BrH/c12-8-2-1-7(5-9(8)13)10(16)6-17-11-14-3-4-15-11;/h1-2,5H,3-4,6H2,(H,14,15);1H