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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C(=N1)SCC(=O)C)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCCCC1=NC2=C(C(=N1)SCC(=O)C)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C15H20N4O3S/c1-5-6-7-10-16-12-11(13(17-10)23-8-9(2)20)14(21)19(4)15(22)18(12)3/h5-8H2,1-4H3