2-[(2-nitrophenyl)methylsulfanyl]-1H-benzimidazole hydrobromide

Systemtic Name: 2-[(2-nitrophenyl)methylsulfanyl]-1H-benzimidazole hydrobromide Openeye Name: 2-[(2-nitrophenyl)methylsulfanyl]-1H-benzimidazole hydrobromide CAS Name: 2-[(2-nitrophenyl)methylthio]-1H-benzimidazole hydrobromide IUPAC Name: 2-[(2-nitrophenyl)methylsulfanyl]-1H-benzimidazole hydrobromide Traditional Name: 2-[(2-nitrobenzyl)thio]-1H-benzimidazole hydrobromide Formula: C14H12BrN3O2S MolecularWeight: 366.23298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3N2)[N+](=O)[O-].Br

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3N2)[N+](=O)[O-].Br

InChI

InChI=1S/C14H11N3O2S.BrH/c18-17(19)13-8-4-1-5-10(13)9-20-14-15-11-6-2-3-7-12(11)16-14;/h1-8H,9H2,(H,15,16);1H