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

Systemtic Name: 6-[[2,6-bis(fluoranyl)phenyl]methyl]-2-(2-oxidanylidenepropylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 2-acetonylsulfanyl-6-[(2,6-difluorophenyl)methyl]-1H-pyrimidin-4-one CAS Name: 6-[(2,6-difluorophenyl)methyl]-2-(2-oxopropylthio)-1H-pyrimidin-4-one IUPAC Name: 6-[(2,6-difluorophenyl)methyl]-2-(2-oxopropylsulfanyl)-1H-pyrimidin-4-one Traditional Name: 2-(acetonylthio)-6-(2,6-difluorobenzyl)-1H-pyrimidin-4-one Formula: C14H12F2N2O2S MolecularWeight: 310.319086

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NC(=O)C=C(N1)CC2=C(C=CC=C2F)F

Isomeric SMILES

CC(=O)CSC1=NC(=O)C=C(N1)CC2=C(C=CC=C2F)F

InChI

InChI=1S/C14H12F2N2O2S/c1-8(19)7-21-14-17-9(6-13(20)18-14)5-10-11(15)3-2-4-12(10)16/h2-4,6H,5,7H2,1H3,(H,17,18,20)