6-[[2,6-bis(fluoranyl)phenyl]methyl]-5-ethyl-2-(methylsulfanylmethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 6-[[2,6-bis(fluoranyl)phenyl]methyl]-5-ethyl-2-(methylsulfanylmethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 6-[(2,6-difluorophenyl)methyl]-5-ethyl-2-(methylsulfanylmethylsulfanyl)-1H-pyrimidin-4-one CAS Name: 6-[(2,6-difluorophenyl)methyl]-5-ethyl-2-[(methylthio)methylthio]-1H-pyrimidin-4-one IUPAC Name: 6-[(2,6-difluorophenyl)methyl]-5-ethyl-2-(methylsulfanylmethylsulfanyl)-1H-pyrimidin-4-one Traditional Name: 6-(2,6-difluorobenzyl)-5-ethyl-2-[(methylthio)methylthio]-1H-pyrimidin-4-one Formula: C15H16F2N2OS2 MolecularWeight: 342.427146

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SCSC)CC2=C(C=CC=C2F)F

Isomeric SMILES

CCC1=C(NC(=NC1=O)SCSC)CC2=C(C=CC=C2F)F

InChI

InChI=1S/C15H16F2N2OS2/c1-3-9-13(7-10-11(16)5-4-6-12(10)17)18-15(19-14(9)20)22-8-21-2/h4-6H,3,7-8H2,1-2H3,(H,18,19,20)