4-ethyl-3-methylsulfanyl-5-[[3-(trifluoromethyl)phenoxy]methyl]-1,2,4-triazole

Systemtic Name: 4-ethyl-3-methylsulfanyl-5-[[3-(trifluoromethyl)phenoxy]methyl]-1,2,4-triazole Openeye Name: 4-ethyl-3-methylsulfanyl-5-[[3-(trifluoromethyl)phenoxy]methyl]-1,2,4-triazole CAS Name: 4-ethyl-3-(methylthio)-5-[[3-(trifluoromethyl)phenoxy]methyl]-1,2,4-triazole IUPAC Name: 4-ethyl-3-methylsulfanyl-5-[[3-(trifluoromethyl)phenoxy]methyl]-1,2,4-triazole Traditional Name: 4-ethyl-3-(methylthio)-5-[[3-(trifluoromethyl)phenoxy]methyl]-1,2,4-triazole Formula: C13H14F3N3OS MolecularWeight: 317.32997

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC)COC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCN1C(=NN=C1SC)COC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C13H14F3N3OS/c1-3-19-11(17-18-12(19)21-2)8-20-10-6-4-5-9(7-10)13(14,15)16/h4-7H,3,8H2,1-2H3