2-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanoic acid Openeye Name: 2-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetic acid CAS Name: 2-[[4-tert-butyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]acetic acid IUPAC Name: 2-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetic acid Traditional Name: 2-[[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]thio]acetic acid Formula: C11H13F3N2O2S MolecularWeight: 294.29333

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13F3N2O2S/c1-10(2,3)6-4-7(11(12,13)14)16-9(15-6)19-5-8(17)18/h4H,5H2,1-3H3,(H,17,18)