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

Systemtic Name: 1-(3-fluoranyl-4-methoxy-phenyl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-1,2,4-triazole Openeye Name: 1-(3-fluoro-4-methoxy-phenyl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-1,2,4-triazole CAS Name: 1-(3-fluoro-4-methoxyphenyl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-1,2,4-triazole IUPAC Name: 1-(3-fluoro-4-methoxyphenyl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)-1,2,4-triazole Traditional Name: 1-(3-fluoro-4-methoxy-phenyl)-5-(4-mesylphenyl)-3-(trifluoromethyl)-1,2,4-triazole Formula: C17H13F4N3O3S MolecularWeight: 415.362033

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=NC(=N2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C)F

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=NC(=N2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C)F

InChI

InChI=1S/C17H13F4N3O3S/c1-27-14-8-5-11(9-13(14)18)24-15(22-16(23-24)17(19,20)21)10-3-6-12(7-4-10)28(2,25)26/h3-9H,1-2H3