(5-ethylpyridin-2-yl)methyl-[[3-[(2-fluorophenyl)methyl]-2-methylsulfonyl-imidazol-4-yl]methyl]-methyl-azanium

Systemtic Name: (5-ethylpyridin-2-yl)methyl-[[3-[(2-fluorophenyl)methyl]-2-methylsulfonyl-imidazol-4-yl]methyl]-methyl-azanium Openeye Name: (5-ethyl-2-pyridyl)methyl-[[3-[(2-fluorophenyl)methyl]-2-methylsulfonyl-imidazol-4-yl]methyl]-methyl-ammonium CAS Name: (5-ethyl-2-pyridinyl)methyl-[[3-[(2-fluorophenyl)methyl]-2-methylsulfonyl-4-imidazolyl]methyl]-methylammonium IUPAC Name: (5-ethylpyridin-2-yl)methyl-[[3-[(2-fluorophenyl)methyl]-2-methylsulfonylimidazol-4-yl]methyl]-methylazanium Traditional Name: (5-ethyl-2-pyridyl)methyl-[[3-(2-fluorobenzyl)-2-mesyl-imidazol-4-yl]methyl]-methyl-ammonium Formula: C21H26FN4O2S+ MolecularWeight: 417.520143

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)C[NH+](C)CC2=CN=C(N2CC3=CC=CC=C3F)S(=O)(=O)C

Isomeric SMILES

CCC1=CN=C(C=C1)C[NH+](C)CC2=CN=C(N2CC3=CC=CC=C3F)S(=O)(=O)C

InChI

InChI=1S/C21H25FN4O2S/c1-4-16-9-10-18(23-11-16)14-25(2)15-19-12-24-21(29(3,27)28)26(19)13-17-7-5-6-8-20(17)22/h5-12H,4,13-15H2,1-3H3/p+1