[3-[(2-fluorophenyl)methyl]-2-methylsulfonyl-imidazol-4-yl]methyl-methyl-[(1S)-1-pyridin-2-ylethyl]azanium

Systemtic Name: [3-[(2-fluorophenyl)methyl]-2-methylsulfonyl-imidazol-4-yl]methyl-methyl-[(1S)-1-pyridin-2-ylethyl]azanium Openeye Name: [3-[(2-fluorophenyl)methyl]-2-methylsulfonyl-imidazol-4-yl]methyl-methyl-[(1S)-1-(2-pyridyl)ethyl]ammonium CAS Name: [3-[(2-fluorophenyl)methyl]-2-methylsulfonyl-4-imidazolyl]methyl-methyl-[(1S)-1-(2-pyridinyl)ethyl]ammonium IUPAC Name: [3-[(2-fluorophenyl)methyl]-2-methylsulfonylimidazol-4-yl]methyl-methyl-[(1S)-1-pyridin-2-ylethyl]azanium Traditional Name: [3-(2-fluorobenzyl)-2-mesyl-imidazol-4-yl]methyl-methyl-[(1S)-1-(2-pyridyl)ethyl]ammonium Formula: C20H24FN4O2S+ MolecularWeight: 403.493563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=N1)[NH+](C)CC2=CN=C(N2CC3=CC=CC=C3F)S(=O)(=O)C

Isomeric SMILES

C[C@@H](C1=CC=CC=N1)[NH+](C)CC2=CN=C(N2CC3=CC=CC=C3F)S(=O)(=O)C

InChI

InChI=1S/C20H23FN4O2S/c1-15(19-10-6-7-11-22-19)24(2)14-17-12-23-20(28(3,26)27)25(17)13-16-8-4-5-9-18(16)21/h4-12,15H,13-14H2,1-3H3/p+1/t15-/m0/s1