5-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-phenyl-1,2-oxazole

Systemtic Name: 5-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-phenyl-1,2-oxazole Openeye Name: 5-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-phenyl-isoxazole CAS Name: 5-[[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]methyl]-3-phenylisoxazole IUPAC Name: 5-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-phenyl-1,2-oxazole Traditional Name: 5-[[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]methyl]-3-phenyl-isoxazole Formula: C14H11F3N4OS MolecularWeight: 340.32355

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC(=NO2)C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CN1C(=NN=C1SCC2=CC(=NO2)C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C14H11F3N4OS/c1-21-12(14(15,16)17)18-19-13(21)23-8-10-7-11(20-22-10)9-5-3-2-4-6-9/h2-7H,8H2,1H3