S-(4-phenylpyrimidin-2-yl) 2,2,2-tris(fluoranyl)ethanethioate

Systemtic Name: S-(4-phenylpyrimidin-2-yl) 2,2,2-tris(fluoranyl)ethanethioate Openeye Name: S-(4-phenylpyrimidin-2-yl) 2,2,2-trifluoroethanethioate CAS Name: 2,2,2-trifluoroethanethioic acid S-(4-phenyl-2-pyrimidinyl) ester IUPAC Name: S-(4-phenylpyrimidin-2-yl) 2,2,2-trifluoroethanethioate Traditional Name: 2,2,2-trifluoroethanethioic acid S-(4-phenylpyrimidin-2-yl) ester Formula: C12H7F3N2OS MolecularWeight: 284.25699

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC=C2)SC(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC=C2)SC(=O)C(F)(F)F

InChI

InChI=1S/C12H7F3N2OS/c13-12(14,15)10(18)19-11-16-7-6-9(17-11)8-4-2-1-3-5-8/h1-7H