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

Systemtic Name: 6-[[2,6-bis(fluoranyl)phenyl]methyl]-2-(methylsulfanylmethylsulfanyl)-5-propan-2-yl-1H-pyrimidin-4-one Openeye Name: 6-[(2,6-difluorophenyl)methyl]-5-isopropyl-2-(methylsulfanylmethylsulfanyl)-1H-pyrimidin-4-one CAS Name: 6-[(2,6-difluorophenyl)methyl]-2-[(methylthio)methylthio]-5-propan-2-yl-1H-pyrimidin-4-one IUPAC Name: 6-[(2,6-difluorophenyl)methyl]-2-(methylsulfanylmethylsulfanyl)-5-propan-2-yl-1H-pyrimidin-4-one Traditional Name: 6-(2,6-difluorobenzyl)-5-isopropyl-2-[(methylthio)methylthio]-1H-pyrimidin-4-one Formula: C16H18F2N2OS2 MolecularWeight: 356.453726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(NC(=NC1=O)SCSC)CC2=C(C=CC=C2F)F

Isomeric SMILES

CC(C)C1=C(NC(=NC1=O)SCSC)CC2=C(C=CC=C2F)F

InChI

InChI=1S/C16H18F2N2OS2/c1-9(2)14-13(7-10-11(17)5-4-6-12(10)18)19-16(20-15(14)21)23-8-22-3/h4-6,9H,7-8H2,1-3H3,(H,19,20,21)