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

Systemtic Name: 3-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-thiophen-2-yl-1,2-oxazole Openeye Name: 3-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-(2-thienyl)isoxazole CAS Name: 3-[[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]methyl]-5-thiophen-2-ylisoxazole IUPAC Name: 3-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-5-thiophen-2-yl-1,2-oxazole Traditional Name: 3-[[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]methyl]-5-(2-thienyl)isoxazole Formula: C12H9F3N4OS2 MolecularWeight: 346.35127

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=NOC(=C2)C3=CC=CS3)C(F)(F)F

Isomeric SMILES

CN1C(=NN=C1SCC2=NOC(=C2)C3=CC=CS3)C(F)(F)F

InChI

InChI=1S/C12H9F3N4OS2/c1-19-10(12(13,14)15)16-17-11(19)22-6-7-5-8(20-18-7)9-3-2-4-21-9/h2-5H,6H2,1H3