(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl-[(6-fluoranyl-1H-benzimidazol-2-yl)methyl]-methyl-azanium

Systemtic Name: (3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl-[(6-fluoranyl-1H-benzimidazol-2-yl)methyl]-methyl-azanium Openeye Name: (3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-methyl-ammonium CAS Name: (3-butyl-2-ethylsulfonyl-4-imidazolyl)methyl-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-methylammonium IUPAC Name: (3-butyl-2-ethylsulfonylimidazol-4-yl)methyl-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-methylazanium Traditional Name: (3-butyl-2-esyl-imidazol-4-yl)methyl-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-methyl-ammonium Formula: C19H27FN5O2S+ MolecularWeight: 408.513383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC)C[NH+](C)CC2=NC3=C(N2)C=C(C=C3)F

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC)C[NH+](C)CC2=NC3=C(N2)C=C(C=C3)F

InChI

InChI=1S/C19H26FN5O2S/c1-4-6-9-25-15(11-21-19(25)28(26,27)5-2)12-24(3)13-18-22-16-8-7-14(20)10-17(16)23-18/h7-8,10-11H,4-6,9,12-13H2,1-3H3,(H,22,23)/p+1