N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]benzenesulfonamide

Systemtic Name: N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]benzenesulfonamide Openeye Name: N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]benzenesulfonamide CAS Name: N-[1-methyl-2-[2-(1-pyrrolidin-1-iumyl)ethyl]-5-benzimidazolyl]benzenesulfonamide IUPAC Name: N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]benzenesulfonamide Traditional Name: N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]benzenesulfonamide Formula: C20H25N4O2S+ MolecularWeight: 385.5031

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)N=C1CC[NH+]4CCCC4

Isomeric SMILES

CN1C2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)N=C1CC[NH+]4CCCC4

InChI

InChI=1S/C20H24N4O2S/c1-23-19-10-9-16(22-27(25,26)17-7-3-2-4-8-17)15-18(19)21-20(23)11-14-24-12-5-6-13-24/h2-4,7-10,15,22H,5-6,11-14H2,1H3/p+1