2-[2,6-bis(fluoranyl)phenyl]-2-pyrimidin-2-ylsulfanyl-ethanoic acid

Systemtic Name: 2-[2,6-bis(fluoranyl)phenyl]-2-pyrimidin-2-ylsulfanyl-ethanoic acid Openeye Name: 2-(2,6-difluorophenyl)-2-pyrimidin-2-ylsulfanyl-acetic acid CAS Name: 2-(2,6-difluorophenyl)-2-(2-pyrimidinylthio)acetic acid IUPAC Name: 2-(2,6-difluorophenyl)-2-pyrimidin-2-ylsulfanylacetic acid Traditional Name: 2-(2,6-difluorophenyl)-2-(2-pyrimidylthio)acetic acid Formula: C12H8F2N2O2S MolecularWeight: 282.265926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)C(C(=O)O)SC2=NC=CC=N2)F

Isomeric SMILES

C1=CC(=C(C(=C1)F)C(C(=O)O)SC2=NC=CC=N2)F

InChI

InChI=1S/C12H8F2N2O2S/c13-7-3-1-4-8(14)9(7)10(11(17)18)19-12-15-5-2-6-16-12/h1-6,10H,(H,17,18)