[3-[(2-fluorophenyl)methyl]-2-methylsulfonyl-imidazol-4-yl]methyl-methyl-[(1-methylpyrazol-4-yl)methyl]azanium

Systemtic Name: [3-[(2-fluorophenyl)methyl]-2-methylsulfonyl-imidazol-4-yl]methyl-methyl-[(1-methylpyrazol-4-yl)methyl]azanium Openeye Name: [3-[(2-fluorophenyl)methyl]-2-methylsulfonyl-imidazol-4-yl]methyl-methyl-[(1-methylpyrazol-4-yl)methyl]ammonium CAS Name: [3-[(2-fluorophenyl)methyl]-2-methylsulfonyl-4-imidazolyl]methyl-methyl-[(1-methyl-4-pyrazolyl)methyl]ammonium IUPAC Name: [3-[(2-fluorophenyl)methyl]-2-methylsulfonylimidazol-4-yl]methyl-methyl-[(1-methylpyrazol-4-yl)methyl]azanium Traditional Name: [3-(2-fluorobenzyl)-2-mesyl-imidazol-4-yl]methyl-methyl-[(1-methylpyrazol-4-yl)methyl]ammonium Formula: C18H23FN5O2S+ MolecularWeight: 392.470923

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C[NH+](C)CC2=CN=C(N2CC3=CC=CC=C3F)S(=O)(=O)C

Isomeric SMILES

CN1C=C(C=N1)C[NH+](C)CC2=CN=C(N2CC3=CC=CC=C3F)S(=O)(=O)C

InChI

InChI=1S/C18H22FN5O2S/c1-22(10-14-8-21-23(2)11-14)13-16-9-20-18(27(3,25)26)24(16)12-15-6-4-5-7-17(15)19/h4-9,11H,10,12-13H2,1-3H3/p+1