4-chloranyl-N-[1-methyl-2-(2-morpholin-4-ium-4-ylethyl)benzimidazol-5-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[1-methyl-2-(2-morpholin-4-ium-4-ylethyl)benzimidazol-5-yl]benzenesulfonamide Openeye Name: 4-chloro-N-[1-methyl-2-(2-morpholin-4-ium-4-ylethyl)benzimidazol-5-yl]benzenesulfonamide CAS Name: 4-chloro-N-[1-methyl-2-[2-(4-morpholin-4-iumyl)ethyl]-5-benzimidazolyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[1-methyl-2-(2-morpholin-4-ium-4-ylethyl)benzimidazol-5-yl]benzenesulfonamide Traditional Name: 4-chloro-N-[1-methyl-2-(2-morpholin-4-ium-4-ylethyl)benzimidazol-5-yl]benzenesulfonamide Formula: C20H24ClN4O3S+ MolecularWeight: 435.94756

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)N=C1CC[NH+]4CCOCC4

Isomeric SMILES

CN1C2=C(C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)N=C1CC[NH+]4CCOCC4

InChI

InChI=1S/C20H23ClN4O3S/c1-24-19-7-4-16(23-29(26,27)17-5-2-15(21)3-6-17)14-18(19)22-20(24)8-9-25-10-12-28-13-11-25/h2-7,14,23H,8-13H2,1H3/p+1