5-[2-fluoranyl-4-(trifluoromethyl)phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-1,2,4-triazole

Systemtic Name: 5-[2-fluoranyl-4-(trifluoromethyl)phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-1,2,4-triazole Openeye Name: 5-[2-fluoro-4-(trifluoromethyl)phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-1,2,4-triazole CAS Name: 5-[2-fluoro-4-(trifluoromethyl)phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-1,2,4-triazole IUPAC Name: 5-[2-fluoro-4-(trifluoromethyl)phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-1,2,4-triazole Traditional Name: 5-[2-fluoro-4-(trifluoromethyl)phenyl]-1-(4-mesylphenyl)-3-(trifluoromethyl)-1,2,4-triazole Formula: C17H10F7N3O2S MolecularWeight: 453.334022

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C(=NC(=N2)C(F)(F)F)C3=C(C=C(C=C3)C(F)(F)F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C(=NC(=N2)C(F)(F)F)C3=C(C=C(C=C3)C(F)(F)F)F

InChI

InChI=1S/C17H10F7N3O2S/c1-30(28,29)11-5-3-10(4-6-11)27-14(25-15(26-27)17(22,23)24)12-7-2-9(8-13(12)18)16(19,20)21/h2-8H,1H3