7-tert-butyl-5-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 7-tert-butyl-5-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 5-[(5-acetyl-2-ethoxy-phenyl)methylsulfanyl]-7-tert-butyl-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 5-[(5-acetyl-2-ethoxyphenyl)methylthio]-7-tert-butyl-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 5-[(5-acetyl-2-ethoxyphenyl)methylsulfanyl]-7-tert-butyl-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 5-[(5-acetyl-2-ethoxy-benzyl)thio]-7-tert-butyl-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C23H28N4O4S MolecularWeight: 456.55782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NC(=NC3=C2C(=O)N(C(=O)N3C)C)C(C)(C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NC(=NC3=C2C(=O)N(C(=O)N3C)C)C(C)(C)C

InChI

InChI=1S/C23H28N4O4S/c1-8-31-16-10-9-14(13(2)28)11-15(16)12-32-19-17-18(24-21(25-19)23(3,4)5)26(6)22(30)27(7)20(17)29/h9-11H,8,12H2,1-7H3