2-prop-2-enylsulfanyl-1H-benzimidazole hydrate hydrobromide

Systemtic Name: 2-prop-2-enylsulfanyl-1H-benzimidazole hydrate hydrobromide Openeye Name: 2-allylsulfanyl-1H-benzimidazole hydrate hydrobromide CAS Name: 2-(prop-2-enylthio)-1H-benzimidazole hydrate hydrobromide IUPAC Name: 2-prop-2-enylsulfanyl-1H-benzimidazole hydrate hydrobromide Traditional Name: 2-(allylthio)-1H-benzimidazole hydrate hydrobromide Formula: C10H13BrN2OS MolecularWeight: 289.19202

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC2=CC=CC=C2N1.O.Br

Isomeric SMILES

C=CCSC1=NC2=CC=CC=C2N1.O.Br

InChI

InChI=1S/C10H10N2S.BrH.H2O/c1-2-7-13-10-11-8-5-3-4-6-9(8)12-10;;/h2-6H,1,7H2,(H,11,12);1H;1H2