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

Systemtic Name: 2-[2-pyridin-2-yl-6-(trifluoromethyl)pyrimidin-4-yl]sulfanylethanoic acid Openeye Name: 2-[2-(2-pyridyl)-6-(trifluoromethyl)pyrimidin-4-yl]sulfanylacetic acid CAS Name: 2-[[2-(2-pyridinyl)-6-(trifluoromethyl)-4-pyrimidinyl]thio]acetic acid IUPAC Name: 2-[2-pyridin-2-yl-6-(trifluoromethyl)pyrimidin-4-yl]sulfanylacetic acid Traditional Name: 2-[[2-(2-pyridyl)-6-(trifluoromethyl)pyrimidin-4-yl]thio]acetic acid Formula: C12H8F3N3O2S MolecularWeight: 315.27103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NC(=CC(=N2)SCC(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC=NC(=C1)C2=NC(=CC(=N2)SCC(=O)O)C(F)(F)F

InChI

InChI=1S/C12H8F3N3O2S/c13-12(14,15)8-5-9(21-6-10(19)20)18-11(17-8)7-3-1-2-4-16-7/h1-5H,6H2,(H,19,20)