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

Systemtic Name: 6-[[2,6-bis(fluoranyl)phenyl]methyl]-2-phenethylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-[(2,6-difluorophenyl)methyl]-2-phenethylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-[(2,6-difluorophenyl)methyl]-2-(phenethylthio)-1H-pyrimidin-4-one IUPAC Name: 6-[(2,6-difluorophenyl)methyl]-2-phenethylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-(2,6-difluorobenzyl)-2-(phenethylthio)-1H-pyrimidin-4-one Formula: C19H16F2N2OS MolecularWeight: 358.404946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSC2=NC(=O)C=C(N2)CC3=C(C=CC=C3F)F

Isomeric SMILES

C1=CC=C(C=C1)CCSC2=NC(=O)C=C(N2)CC3=C(C=CC=C3F)F

InChI

InChI=1S/C19H16F2N2OS/c20-16-7-4-8-17(21)15(16)11-14-12-18(24)23-19(22-14)25-10-9-13-5-2-1-3-6-13/h1-8,12H,9-11H2,(H,22,23,24)