2-[3,4,4-tris(fluoranyl)but-3-enylsulfanyl]-1H-pyrimidin-6-one

Systemtic Name: 2-[3,4,4-tris(fluoranyl)but-3-enylsulfanyl]-1H-pyrimidin-6-one Openeye Name: 2-(3,4,4-trifluorobut-3-enylsulfanyl)-1H-pyrimidin-6-one CAS Name: 2-(3,4,4-trifluorobut-3-enylthio)-1H-pyrimidin-6-one IUPAC Name: 2-(3,4,4-trifluorobut-3-enylsulfanyl)-1H-pyrimidin-6-one Traditional Name: 2-(3,4,4-trifluorobut-3-enylthio)-1H-pyrimidin-6-one Formula: C8H7F3N2OS MolecularWeight: 236.21419

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(NC1=O)SCCC(=C(F)F)F

Isomeric SMILES

C1=CN=C(NC1=O)SCCC(=C(F)F)F

InChI

InChI=1S/C8H7F3N2OS/c9-5(7(10)11)2-4-15-8-12-3-1-6(14)13-8/h1,3H,2,4H2,(H,12,13,14)