2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4,5-dihydro-1H-imidazol-3-ium bromide

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4,5-dihydro-1H-imidazol-3-ium bromide Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-4,5-dihydro-1H-imidazol-3-ium bromide CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-4,5-dihydro-1H-imidazol-3-ium bromide IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4,5-dihydro-1H-imidazol-3-ium bromide Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]-2-imidazolin-1-ium bromide Formula: C10H11BrClFN2S MolecularWeight: 325.628143

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]=C(N1)SCC2=C(C=CC=C2Cl)F.[Br-]

Isomeric SMILES

C1C[NH+]=C(N1)SCC2=C(C=CC=C2Cl)F.[Br-]

InChI

InChI=1S/C10H10ClFN2S.BrH/c11-8-2-1-3-9(12)7(8)6-15-10-13-4-5-14-10;/h1-3H,4-6H2,(H,13,14);1H