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

Systemtic Name: 6-[[2,6-bis(fluoranyl)phenyl]methyl]-5-methyl-2-(2-methylsulfanylethylamino)-1H-pyrimidin-4-one Openeye Name: 6-[(2,6-difluorophenyl)methyl]-5-methyl-2-(2-methylsulfanylethylamino)-1H-pyrimidin-4-one CAS Name: 6-[(2,6-difluorophenyl)methyl]-5-methyl-2-[2-(methylthio)ethylamino]-1H-pyrimidin-4-one IUPAC Name: 6-[(2,6-difluorophenyl)methyl]-5-methyl-2-(2-methylsulfanylethylamino)-1H-pyrimidin-4-one Traditional Name: 6-(2,6-difluorobenzyl)-5-methyl-2-[2-(methylthio)ethylamino]-1H-pyrimidin-4-one Formula: C15H17F2N3OS MolecularWeight: 325.376786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)NCCSC)CC2=C(C=CC=C2F)F

Isomeric SMILES

CC1=C(NC(=NC1=O)NCCSC)CC2=C(C=CC=C2F)F

InChI

InChI=1S/C15H17F2N3OS/c1-9-13(8-10-11(16)4-3-5-12(10)17)19-15(20-14(9)21)18-6-7-22-2/h3-5H,6-8H2,1-2H3,(H2,18,19,20,21)