1,3-dimethyl-7-(2-methylpropyl)-5-(2-oxidanylidenepropylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 1,3-dimethyl-7-(2-methylpropyl)-5-(2-oxidanylidenepropylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 5-acetonylsulfanyl-7-isobutyl-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 1,3-dimethyl-7-(2-methylpropyl)-5-(2-oxopropylthio)pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 1,3-dimethyl-7-(2-methylpropyl)-5-(2-oxopropylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 5-(acetonylthio)-7-isobutyl-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C15H20N4O3S MolecularWeight: 336.4093

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC2=C(C(=N1)SCC(=O)C)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CC(C)CC1=NC2=C(C(=N1)SCC(=O)C)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C15H20N4O3S/c1-8(2)6-10-16-12-11(13(17-10)23-7-9(3)20)14(21)19(5)15(22)18(12)4/h8H,6-7H2,1-5H3