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

Systemtic Name: 4-methyl-N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]benzenesulfonamide Openeye Name: 4-methyl-N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]benzenesulfonamide CAS Name: 4-methyl-N-[1-methyl-2-[2-(1-pyrrolidin-1-iumyl)ethyl]-5-benzimidazolyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]benzenesulfonamide Traditional Name: 4-methyl-N-[1-methyl-2-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazol-5-yl]benzenesulfonamide Formula: C21H27N4O2S+ MolecularWeight: 399.52968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)N(C(=N3)CC[NH+]4CCCC4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)N(C(=N3)CC[NH+]4CCCC4)C

InChI

InChI=1S/C21H26N4O2S/c1-16-5-8-18(9-6-16)28(26,27)23-17-7-10-20-19(15-17)22-21(24(20)2)11-14-25-12-3-4-13-25/h5-10,15,23H,3-4,11-14H2,1-2H3/p+1