2-[8-(4,5-dihydro-1H-imidazol-3-ium-2-yl)dibenzothiophen-2-yl]-4,5-dihydro-1H-imidazol-3-ium dichloride

Systemtic Name: 2-[8-(4,5-dihydro-1H-imidazol-3-ium-2-yl)dibenzothiophen-2-yl]-4,5-dihydro-1H-imidazol-3-ium dichloride Openeye Name: 2-[8-(4,5-dihydro-1H-imidazol-3-ium-2-yl)dibenzothiophen-2-yl]-4,5-dihydro-1H-imidazol-3-ium dichloride CAS Name: 2-[8-(4,5-dihydro-1H-imidazol-3-ium-2-yl)-2-dibenzothiophenyl]-4,5-dihydro-1H-imidazol-3-ium dichloride IUPAC Name: 2-[8-(4,5-dihydro-1H-imidazol-3-ium-2-yl)dibenzothiophen-2-yl]-4,5-dihydro-1H-imidazol-3-ium dichloride Traditional Name: 2-[8-(2-imidazolin-1-ium-2-yl)dibenzothiophen-2-yl]-2-imidazolin-1-ium dichloride Formula: C18H18Cl2N4S MolecularWeight: 393.33332

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]=C(N1)C2=CC3=C(C=C2)SC4=C3C=C(C=C4)C5=[NH+]CCN5.[Cl-].[Cl-]

Isomeric SMILES

C1C[NH+]=C(N1)C2=CC3=C(C=C2)SC4=C3C=C(C=C4)C5=[NH+]CCN5.[Cl-].[Cl-]

InChI

InChI=1S/C18H16N4S.2ClH/c1-3-15-13(9-11(1)17-19-5-6-20-17)14-10-12(2-4-16(14)23-15)18-21-7-8-22-18;;/h1-4,9-10H,5-8H2,(H,19,20)(H,21,22);2*1H