3-[1-(4-methylsulfonylphenyl)-4-(trifluoromethyl)imidazol-2-yl]-1-oxidanidyl-pyridin-1-ium

Systemtic Name: 3-[1-(4-methylsulfonylphenyl)-4-(trifluoromethyl)imidazol-2-yl]-1-oxidanidyl-pyridin-1-ium Openeye Name: 3-[1-(4-methylsulfonylphenyl)-4-(trifluoromethyl)imidazol-2-yl]-1-oxido-pyridin-1-ium CAS Name: 3-[1-(4-methylsulfonylphenyl)-4-(trifluoromethyl)-2-imidazolyl]-1-oxidopyridin-1-ium IUPAC Name: 3-[1-(4-methylsulfonylphenyl)-4-(trifluoromethyl)imidazol-2-yl]-1-oxidopyridin-1-ium Traditional Name: 3-[1-(4-mesylphenyl)-4-(trifluoromethyl)imidazol-2-yl]-1-oxido-pyridin-1-ium Formula: C16H12F3N3O3S MolecularWeight: 383.34499

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C=C(N=C2C3=C[N+](=CC=C3)[O-])C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C=C(N=C2C3=C[N+](=CC=C3)[O-])C(F)(F)F

InChI

InChI=1S/C16H12F3N3O3S/c1-26(24,25)13-6-4-12(5-7-13)22-10-14(16(17,18)19)20-15(22)11-3-2-8-21(23)9-11/h2-10H,1H3