2-(2-bromanylprop-2-enylsulfanylmethyl)-1H-benzimidazol-3-ium

Systemtic Name: 2-(2-bromanylprop-2-enylsulfanylmethyl)-1H-benzimidazol-3-ium Openeye Name: 2-(2-bromoallylsulfanylmethyl)-1H-benzimidazol-3-ium CAS Name: 2-[(2-bromoprop-2-enylthio)methyl]-1H-benzimidazol-3-ium IUPAC Name: 2-(2-bromoprop-2-enylsulfanylmethyl)-1H-benzimidazol-3-ium Traditional Name: 2-[(2-bromoallylthio)methyl]-1H-benzimidazol-3-ium Formula: C11H12BrN2S+ MolecularWeight: 284.19538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C(CSCC1=[NH+]C2=CC=CC=C2N1)Br

Isomeric SMILES

C=C(CSCC1=[NH+]C2=CC=CC=C2N1)Br

InChI

InChI=1S/C11H11BrN2S/c1-8(12)6-15-7-11-13-9-4-2-3-5-10(9)14-11/h2-5H,1,6-7H2,(H,13,14)/p+1