S-[5-(trifluoromethyl)pyridin-2-yl] 3-methyl-5-(trifluoromethyl)-1,2-oxazole-4-carbothioate

Systemtic Name: S-[5-(trifluoromethyl)pyridin-2-yl] 3-methyl-5-(trifluoromethyl)-1,2-oxazole-4-carbothioate Openeye Name: S-[5-(trifluoromethyl)-2-pyridyl] 3-methyl-5-(trifluoromethyl)isoxazole-4-carbothioate CAS Name: 3-methyl-5-(trifluoromethyl)-4-isoxazolecarbothioic acid S-[5-(trifluoromethyl)-2-pyridinyl] ester IUPAC Name: S-[5-(trifluoromethyl)pyridin-2-yl] 3-methyl-5-(trifluoromethyl)-1,2-oxazole-4-carbothioate Traditional Name: 3-methyl-5-(trifluoromethyl)isoxazole-4-carbothioic acid S-[5-(trifluoromethyl)-2-pyridyl] ester Formula: C12H6F6N2O2S MolecularWeight: 356.243659

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)SC2=NC=C(C=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1=NOC(=C1C(=O)SC2=NC=C(C=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C12H6F6N2O2S/c1-5-8(9(22-20-5)12(16,17)18)10(21)23-7-3-2-6(4-19-7)11(13,14)15/h2-4H,1H3