6-[1-[2,6-bis(fluoranyl)phenyl]ethyl]-2-methylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-[1-[2,6-bis(fluoranyl)phenyl]ethyl]-2-methylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-[1-(2,6-difluorophenyl)ethyl]-2-methylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-[1-(2,6-difluorophenyl)ethyl]-2-(methylthio)-1H-pyrimidin-4-one IUPAC Name: 6-[1-(2,6-difluorophenyl)ethyl]-2-methylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-[1-(2,6-difluorophenyl)ethyl]-2-(methylthio)-1H-pyrimidin-4-one Formula: C13H12F2N2OS MolecularWeight: 282.308986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=O)N=C(N1)SC)C2=C(C=CC=C2F)F

Isomeric SMILES

CC(C1=CC(=O)N=C(N1)SC)C2=C(C=CC=C2F)F

InChI

InChI=1S/C13H12F2N2OS/c1-7(12-8(14)4-3-5-9(12)15)10-6-11(18)17-13(16-10)19-2/h3-7H,1-2H3,(H,16,17,18)