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

Systemtic Name: 7-tert-butyl-1,3-dimethyl-5-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-tert-butyl-1,3-dimethyl-5-[(5-phenylisoxazol-3-yl)methylsulfanyl]pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-tert-butyl-1,3-dimethyl-5-[(5-phenyl-3-isoxazolyl)methylthio]pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-tert-butyl-1,3-dimethyl-5-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]pyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 7-tert-butyl-1,3-dimethyl-5-[(5-phenylisoxazol-3-yl)methylthio]pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C22H23N5O3S MolecularWeight: 437.51472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(C(=N1)SCC3=NOC(=C3)C4=CC=CC=C4)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CC(C)(C)C1=NC2=C(C(=N1)SCC3=NOC(=C3)C4=CC=CC=C4)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C22H23N5O3S/c1-22(2,3)20-23-17-16(19(28)27(5)21(29)26(17)4)18(24-20)31-12-14-11-15(30-25-14)13-9-7-6-8-10-13/h6-11H,12H2,1-5H3