3-methyl-5-(4-methylphenyl)-2-methylsulfanyl-6,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-4,7-dione

Systemtic Name: 3-methyl-5-(4-methylphenyl)-2-methylsulfanyl-6,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-4,7-dione Openeye Name: 3-methyl-2-methylsulfanyl-5-(p-tolyl)-6,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-4,7-dione CAS Name: 3-methyl-5-(4-methylphenyl)-2-(methylthio)-6,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-4,7-dione IUPAC Name: 3-methyl-5-(4-methylphenyl)-2-methylsulfanyl-6,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-4,7-dione Traditional Name: 3-methyl-2-(methylthio)-5-(p-tolyl)-6,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-4,7-quinone Formula: C15H16N4O2S MolecularWeight: 316.37814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C3=C(NC(=O)N2)N=C(N(C3=O)C)SC

Isomeric SMILES

CC1=CC=C(C=C1)C2C3=C(NC(=O)N2)N=C(N(C3=O)C)SC

InChI

InChI=1S/C15H16N4O2S/c1-8-4-6-9(7-5-8)11-10-12(17-14(21)16-11)18-15(22-3)19(2)13(10)20/h4-7,11H,1-3H3,(H2,16,17,21)