8-cyclohexyl-4-(4-fluoranyl-2-methyl-phenyl)-2-methylsulfanyl-5,6-dihydropyrimido[4,5-d]pyrimidin-7-one

Systemtic Name: 8-cyclohexyl-4-(4-fluoranyl-2-methyl-phenyl)-2-methylsulfanyl-5,6-dihydropyrimido[4,5-d]pyrimidin-7-one Openeye Name: 8-cyclohexyl-4-(4-fluoro-2-methyl-phenyl)-2-methylsulfanyl-5,6-dihydropyrimido[4,5-d]pyrimidin-7-one CAS Name: 8-cyclohexyl-4-(4-fluoro-2-methylphenyl)-2-(methylthio)-5,6-dihydropyrimido[4,5-d]pyrimidin-7-one IUPAC Name: 8-cyclohexyl-4-(4-fluoro-2-methylphenyl)-2-methylsulfanyl-5,6-dihydropyrimido[4,5-d]pyrimidin-7-one Traditional Name: 8-cyclohexyl-4-(4-fluoro-2-methyl-phenyl)-2-(methylthio)-5,6-dihydropyrimido[4,5-d]pyrimidin-7-one Formula: C20H23FN4OS MolecularWeight: 386.486223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)C2=C3CNC(=O)N(C3=NC(=N2)SC)C4CCCCC4

Isomeric SMILES

CC1=C(C=CC(=C1)F)C2=C3CNC(=O)N(C3=NC(=N2)SC)C4CCCCC4

InChI

InChI=1S/C20H23FN4OS/c1-12-10-13(21)8-9-15(12)17-16-11-22-20(26)25(14-6-4-3-5-7-14)18(16)24-19(23-17)27-2/h8-10,14H,3-7,11H2,1-2H3,(H,22,26)