[1-(1,3-dimethylbenzimidazol-3-ium-2-yl)cyclobutyl]-[(E)-methylsulfonyldiazenyl]azanide

Systemtic Name: [1-(1,3-dimethylbenzimidazol-3-ium-2-yl)cyclobutyl]-[(E)-methylsulfonyldiazenyl]azanide Openeye Name: [1-(1,3-dimethylbenzimidazol-3-ium-2-yl)cyclobutyl]-[(E)-methylsulfonylazo]azanide CAS Name: [1-(1,3-dimethyl-2-benzimidazol-3-iumyl)cyclobutyl]-[(E)-methylsulfonylazo]azanide IUPAC Name: [1-(1,3-dimethylbenzimidazol-3-ium-2-yl)cyclobutyl]-[(E)-methylsulfonyldiazenyl]azanide Traditional Name: [1-(1,3-dimethylbenzimidazol-3-ium-2-yl)cyclobutyl]-[(E)-mesylazo]azanide Formula: C14H19N5O2S MolecularWeight: 321.39796

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2[N+](=C1C3(CCC3)[N-]N=NS(=O)(=O)C)C

Isomeric SMILES

CN1C2=CC=CC=C2[N+](=C1C3(CCC3)[N-]/N=N/S(=O)(=O)C)C

InChI

InChI=1S/C14H19N5O2S/c1-18-11-7-4-5-8-12(11)19(2)13(18)14(9-6-10-14)15-16-17-22(3,20)21/h4-5,7-8H,6,9-10H2,1-3H3