methyl 2-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanoate Openeye Name: methyl 2-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[4-tert-butyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]thio]acetic acid methyl ester Formula: C12H15F3N2O2S MolecularWeight: 308.31991

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC(=N1)SCC(=O)OC)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC(=NC(=N1)SCC(=O)OC)C(F)(F)F

InChI

InChI=1S/C12H15F3N2O2S/c1-11(2,3)7-5-8(12(13,14)15)17-10(16-7)20-6-9(18)19-4/h5H,6H2,1-4H3