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

Systemtic Name: 5-[(2-bromanyl-4-fluoranyl-phenyl)methylsulfanyl]-7-tert-butyl-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 5-[(2-bromo-4-fluoro-phenyl)methylsulfanyl]-7-tert-butyl-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 5-[(2-bromo-4-fluorophenyl)methylthio]-7-tert-butyl-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 5-[(2-bromo-4-fluorophenyl)methylsulfanyl]-7-tert-butyl-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 5-[(2-bromo-4-fluoro-benzyl)thio]-7-tert-butyl-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C19H20BrFN4O2S MolecularWeight: 467.355103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(C(=N1)SCC3=C(C=C(C=C3)F)Br)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CC(C)(C)C1=NC2=C(C(=N1)SCC3=C(C=C(C=C3)F)Br)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C19H20BrFN4O2S/c1-19(2,3)17-22-14-13(16(26)25(5)18(27)24(14)4)15(23-17)28-9-10-6-7-11(21)8-12(10)20/h6-8H,9H2,1-5H3