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

Systemtic Name: 4-(4-fluoranyl-2-methyl-phenyl)-8-(2-methylphenyl)-2-methylsulfanyl-5,6-dihydropyrimido[4,5-d]pyrimidin-7-one Openeye Name: 4-(4-fluoro-2-methyl-phenyl)-2-methylsulfanyl-8-(o-tolyl)-5,6-dihydropyrimido[4,5-d]pyrimidin-7-one CAS Name: 4-(4-fluoro-2-methylphenyl)-8-(2-methylphenyl)-2-(methylthio)-5,6-dihydropyrimido[4,5-d]pyrimidin-7-one IUPAC Name: 4-(4-fluoro-2-methylphenyl)-8-(2-methylphenyl)-2-methylsulfanyl-5,6-dihydropyrimido[4,5-d]pyrimidin-7-one Traditional Name: 4-(4-fluoro-2-methyl-phenyl)-2-(methylthio)-8-(o-tolyl)-5,6-dihydropyrimido[4,5-d]pyrimidin-7-one Formula: C21H19FN4OS MolecularWeight: 394.465163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C3=NC(=NC(=C3CNC2=O)C4=C(C=C(C=C4)F)C)SC

Isomeric SMILES

CC1=CC=CC=C1N2C3=NC(=NC(=C3CNC2=O)C4=C(C=C(C=C4)F)C)SC

InChI

InChI=1S/C21H19FN4OS/c1-12-6-4-5-7-17(12)26-19-16(11-23-21(26)27)18(24-20(25-19)28-3)15-9-8-14(22)10-13(15)2/h4-10H,11H2,1-3H3,(H,23,27)