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

Systemtic Name: 4-fluoranyl-N-[1-methyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]benzenesulfonamide Openeye Name: 4-fluoro-N-[1-methyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]benzenesulfonamide CAS Name: 4-fluoro-N-[1-methyl-2-(4-morpholin-4-iumylmethyl)-5-benzimidazolyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[1-methyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]benzenesulfonamide Traditional Name: 4-fluoro-N-[1-methyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]benzenesulfonamide Formula: C19H22FN4O3S+ MolecularWeight: 405.466383

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)F)N=C1C[NH+]4CCOCC4

Isomeric SMILES

CN1C2=C(C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)F)N=C1C[NH+]4CCOCC4

InChI

InChI=1S/C19H21FN4O3S/c1-23-18-7-4-15(22-28(25,26)16-5-2-14(20)3-6-16)12-17(18)21-19(23)13-24-8-10-27-11-9-24/h2-7,12,22H,8-11,13H2,1H3/p+1