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

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

Systemtic Name:6-[[2,6-bis(fluoranyl)phenyl]methyl]-2-cyclohexylsulfanyl-5-methyl-1H-pyrimidin-4-one
Openeye Name:2-cyclohexylsulfanyl-6-[(2,6-difluorophenyl)methyl]-5-methyl-1H-pyrimidin-4-one
CAS Name:2-(cyclohexylthio)-6-[(2,6-difluorophenyl)methyl]-5-methyl-1H-pyrimidin-4-one
IUPAC Name:2-cyclohexylsulfanyl-6-[(2,6-difluorophenyl)methyl]-5-methyl-1H-pyrimidin-4-one
Traditional Name:2-(cyclohexylthio)-6-(2,6-difluorobenzyl)-5-methyl-1H-pyrimidin-4-one
Formula: C18H20F2N2OS
MolecularWeight: 350.426006
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SC2CCCCC2)CC3=C(C=CC=C3F)F


Isomeric SMILES

CC1=C(NC(=NC1=O)SC2CCCCC2)CC3=C(C=CC=C3F)F


InChI

InChI=1S/C18H20F2N2OS/c1-11-16(10-13-14(19)8-5-9-15(13)20)21-18(22-17(11)23)24-12-6-3-2-4-7-12/h5,8-9,12H,2-4,6-7,10H2,1H3,(H,21,22,23)


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