[2-(tert-butylamino)-2-oxidanylidene-ethyl]-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl]-ethyl-azanium

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl]-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl]-ethyl-azanium Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl]-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl]-ethyl-ammonium CAS Name: [2-(tert-butylamino)-2-oxoethyl]-[(1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl]-ethylammonium IUPAC Name: [2-(tert-butylamino)-2-oxoethyl]-[(1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl]-ethylazanium Traditional Name: [2-(tert-butylamino)-2-keto-ethyl]-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl]-ethyl-ammonium Formula: C20H34N5O3S+ MolecularWeight: 424.58066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H33N5O3S/c1-6-8-11-25-17-10-9-15(29(21,27)28)12-16(17)22-18(25)13-24(7-2)14-19(26)23-20(3,4)5/h9-10,12H,6-8,11,13-14H2,1-5H3,(H,23,26)(H2,21,27,28)/p+1