1-(4-chlorophenyl)sulfonyl-2-(pyridin-1-ium-3-ylmethylsulfanyl)benzimidazole

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-2-(pyridin-1-ium-3-ylmethylsulfanyl)benzimidazole Openeye Name: 1-(4-chlorophenyl)sulfonyl-2-(pyridin-1-ium-3-ylmethylsulfanyl)benzimidazole CAS Name: 1-(4-chlorophenyl)sulfonyl-2-(3-pyridin-1-iumylmethylthio)benzimidazole IUPAC Name: 1-(4-chlorophenyl)sulfonyl-2-(pyridin-1-ium-3-ylmethylsulfanyl)benzimidazole Traditional Name: 1-(4-chlorophenyl)sulfonyl-2-(pyridin-1-ium-3-ylmethylthio)benzimidazole Formula: C19H15ClN3O2S2+ MolecularWeight: 416.9243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2S(=O)(=O)C3=CC=C(C=C3)Cl)SCC4=C[NH+]=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2S(=O)(=O)C3=CC=C(C=C3)Cl)SCC4=C[NH+]=CC=C4

InChI

InChI=1S/C19H14ClN3O2S2/c20-15-7-9-16(10-8-15)27(24,25)23-18-6-2-1-5-17(18)22-19(23)26-13-14-4-3-11-21-12-14/h1-12H,13H2/p+1