(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl-methyl-(phenylmethyl)azanium

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl]-methyl-ammonium CAS Name: (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl]-methylazanium Traditional Name: benzyl-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl]-methyl-ammonium Formula: C20H27N4O2S+ MolecularWeight: 387.51898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1C[NH+](C)CC3=CC=CC=C3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1C[NH+](C)CC3=CC=CC=C3

InChI

InChI=1S/C20H26N4O2S/c1-3-4-12-24-19-11-10-17(27(21,25)26)13-18(19)22-20(24)15-23(2)14-16-8-6-5-7-9-16/h5-11,13H,3-4,12,14-15H2,1-2H3,(H2,21,25,26)/p+1