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

Systemtic Name: 2-[4,4-bis(fluoranyl)but-3-enylsulfanyl]-6-(methoxymethyl)-1H-pyrimidin-4-one Openeye Name: 2-(4,4-difluorobut-3-enylsulfanyl)-6-(methoxymethyl)-1H-pyrimidin-4-one CAS Name: 2-(4,4-difluorobut-3-enylthio)-6-(methoxymethyl)-1H-pyrimidin-4-one IUPAC Name: 2-(4,4-difluorobut-3-enylsulfanyl)-6-(methoxymethyl)-1H-pyrimidin-4-one Traditional Name: 2-(4,4-difluorobut-3-enylthio)-6-(methoxymethyl)-1H-pyrimidin-4-one Formula: C10H12F2N2O2S MolecularWeight: 262.276286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC(=O)N=C(N1)SCCC=C(F)F

Isomeric SMILES

COCC1=CC(=O)N=C(N1)SCCC=C(F)F

InChI

InChI=1S/C10H12F2N2O2S/c1-16-6-7-5-9(15)14-10(13-7)17-4-2-3-8(11)12/h3,5H,2,4,6H2,1H3,(H,13,14,15)