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

Systemtic Name: 7-butyl-5-(2-hydroxyethylsulfanyl)-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-butyl-5-(2-hydroxyethylsulfanyl)-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-butyl-5-(2-hydroxyethylthio)-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-butyl-5-(2-hydroxyethylsulfanyl)-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 7-butyl-5-(2-hydroxyethylthio)-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C14H20N4O3S MolecularWeight: 324.3986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N4O3S/c1-4-5-6-9-15-11-10(12(16-9)22-8-7-19)13(20)18(3)14(21)17(11)2/h19H,4-8H2,1-3H3