2-(1H-benzimidazol-2-yl)ethyl-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]-methyl-azanium

Systemtic Name: 2-(1H-benzimidazol-2-yl)ethyl-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]-methyl-azanium Openeye Name: 2-(1H-benzimidazol-2-yl)ethyl-[(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl]-methyl-ammonium CAS Name: 2-(1H-benzimidazol-2-yl)ethyl-[(3-butyl-2-ethylsulfonyl-4-imidazolyl)methyl]-methylammonium IUPAC Name: 2-(1H-benzimidazol-2-yl)ethyl-[(3-butyl-2-ethylsulfonylimidazol-4-yl)methyl]-methylazanium Traditional Name: 2-(1H-benzimidazol-2-yl)ethyl-[(3-butyl-2-esyl-imidazol-4-yl)methyl]-methyl-ammonium Formula: C20H30N5O2S+ MolecularWeight: 404.5495

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC)C[NH+](C)CCC2=NC3=CC=CC=C3N2

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC)C[NH+](C)CCC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C20H29N5O2S/c1-4-6-12-25-16(14-21-20(25)28(26,27)5-2)15-24(3)13-11-19-22-17-9-7-8-10-18(17)23-19/h7-10,14H,4-6,11-13,15H2,1-3H3,(H,22,23)/p+1