3-ethyl-2-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-6-(phenylsulfonylamino)benzimidazole-4-carboxamide

Systemtic Name: 3-ethyl-2-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-6-(phenylsulfonylamino)benzimidazole-4-carboxamide Openeye Name: 6-(benzenesulfonamido)-3-ethyl-2-methyl-N-(3-morpholin-4-ium-4-ylpropyl)benzimidazole-4-carboxamide CAS Name: 6-(benzenesulfonamido)-3-ethyl-2-methyl-N-[3-(4-morpholin-4-iumyl)propyl]-4-benzimidazolecarboxamide IUPAC Name: 6-(benzenesulfonamido)-3-ethyl-2-methyl-N-(3-morpholin-4-ium-4-ylpropyl)benzimidazole-4-carboxamide Traditional Name: 6-(benzenesulfonamido)-3-ethyl-2-methyl-N-(3-morpholin-4-ium-4-ylpropyl)benzimidazole-4-carboxamide Formula: C24H32N5O4S+ MolecularWeight: 486.60698

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C1C(=CC(=C2)NS(=O)(=O)C3=CC=CC=C3)C(=O)NCCC[NH+]4CCOCC4)C

Isomeric SMILES

CCN1C(=NC2=C1C(=CC(=C2)NS(=O)(=O)C3=CC=CC=C3)C(=O)NCCC[NH+]4CCOCC4)C

InChI

InChI=1S/C24H31N5O4S/c1-3-29-18(2)26-22-17-19(27-34(31,32)20-8-5-4-6-9-20)16-21(23(22)29)24(30)25-10-7-11-28-12-14-33-15-13-28/h4-6,8-9,16-17,27H,3,7,10-15H2,1-2H3,(H,25,30)/p+1