[3-[(2-fluorophenyl)methyl]-2-propan-2-ylsulfonyl-imidazol-4-yl]methyl-methyl-(pyrazin-2-ylmethyl)azanium

Systemtic Name: [3-[(2-fluorophenyl)methyl]-2-propan-2-ylsulfonyl-imidazol-4-yl]methyl-methyl-(pyrazin-2-ylmethyl)azanium Openeye Name: [3-[(2-fluorophenyl)methyl]-2-isopropylsulfonyl-imidazol-4-yl]methyl-methyl-(pyrazin-2-ylmethyl)ammonium CAS Name: [3-[(2-fluorophenyl)methyl]-2-propan-2-ylsulfonyl-4-imidazolyl]methyl-methyl-(2-pyrazinylmethyl)ammonium IUPAC Name: [3-[(2-fluorophenyl)methyl]-2-propan-2-ylsulfonylimidazol-4-yl]methyl-methyl-(pyrazin-2-ylmethyl)azanium Traditional Name: [3-(2-fluorobenzyl)-2-isopropylsulfonyl-imidazol-4-yl]methyl-methyl-(pyrazin-2-ylmethyl)ammonium Formula: C20H25FN5O2S+ MolecularWeight: 418.508203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2F)C[NH+](C)CC3=NC=CN=C3

Isomeric SMILES

CC(C)S(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2F)C[NH+](C)CC3=NC=CN=C3

InChI

InChI=1S/C20H24FN5O2S/c1-15(2)29(27,28)20-24-11-18(14-25(3)13-17-10-22-8-9-23-17)26(20)12-16-6-4-5-7-19(16)21/h4-11,15H,12-14H2,1-3H3/p+1