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

Systemtic Name: 6-[(1R)-1-[2,6-bis(fluoranyl)phenyl]ethyl]-2-cyclohexylsulfanyl-5-methyl-1H-pyrimidin-4-one Openeye Name: 2-cyclohexylsulfanyl-6-[(1R)-1-(2,6-difluorophenyl)ethyl]-5-methyl-1H-pyrimidin-4-one CAS Name: 2-(cyclohexylthio)-6-[(1R)-1-(2,6-difluorophenyl)ethyl]-5-methyl-1H-pyrimidin-4-one IUPAC Name: 2-cyclohexylsulfanyl-6-[(1R)-1-(2,6-difluorophenyl)ethyl]-5-methyl-1H-pyrimidin-4-one Traditional Name: 2-(cyclohexylthio)-6-[(1R)-1-(2,6-difluorophenyl)ethyl]-5-methyl-1H-pyrimidin-4-one Formula: C19H22F2N2OS MolecularWeight: 364.452586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SC2CCCCC2)C(C)C3=C(C=CC=C3F)F

Isomeric SMILES

CC1=C(NC(=NC1=O)SC2CCCCC2)[C@H](C)C3=C(C=CC=C3F)F

InChI

InChI=1S/C19H22F2N2OS/c1-11(16-14(20)9-6-10-15(16)21)17-12(2)18(24)23-19(22-17)25-13-7-4-3-5-8-13/h6,9-11,13H,3-5,7-8H2,1-2H3,(H,22,23,24)/t11-/m1/s1