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

Systemtic Name: 6-(2-methylphenyl)-2-methylsulfanyl-5,8-dihydropyrimido[4,5-d]pyrimidin-7-one Openeye Name: 2-methylsulfanyl-6-(o-tolyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-7-one CAS Name: 6-(2-methylphenyl)-2-(methylthio)-5,8-dihydropyrimido[4,5-d]pyrimidin-7-one IUPAC Name: 6-(2-methylphenyl)-2-methylsulfanyl-5,8-dihydropyrimido[4,5-d]pyrimidin-7-one Traditional Name: 2-(methylthio)-6-(o-tolyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-7-one Formula: C14H14N4OS MolecularWeight: 286.35216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC3=CN=C(N=C3NC2=O)SC

Isomeric SMILES

CC1=CC=CC=C1N2CC3=CN=C(N=C3NC2=O)SC

InChI

InChI=1S/C14H14N4OS/c1-9-5-3-4-6-11(9)18-8-10-7-15-13(20-2)16-12(10)17-14(18)19/h3-7H,8H2,1-2H3,(H,15,16,17,19)