2-sulfanylidene-5-[2,2,2-tris(fluoranyl)-1-oxidanyl-ethyl]-1H-pyrimidin-4-one

Systemtic Name: 2-sulfanylidene-5-[2,2,2-tris(fluoranyl)-1-oxidanyl-ethyl]-1H-pyrimidin-4-one Openeye Name: 2-thioxo-5-(2,2,2-trifluoro-1-hydroxy-ethyl)-1H-pyrimidin-4-one CAS Name: 2-sulfanylidene-5-(2,2,2-trifluoro-1-hydroxyethyl)-1H-pyrimidin-4-one IUPAC Name: 2-sulfanylidene-5-(2,2,2-trifluoro-1-hydroxyethyl)-1H-pyrimidin-4-one Traditional Name: 2-thioxo-5-(2,2,2-trifluoro-1-hydroxy-ethyl)-1H-pyrimidin-4-one Formula: C6H5F3N2O2S MolecularWeight: 226.17631

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)NC(=S)N1)C(C(F)(F)F)O

Isomeric SMILES

C1=C(C(=O)NC(=S)N1)C(C(F)(F)F)O

InChI

InChI=1S/C6H5F3N2O2S/c7-6(8,9)3(12)2-1-10-5(14)11-4(2)13/h1,3,12H,(H2,10,11,13,14)