7-tert-butyl-5-[(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 7-tert-butyl-5-[(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-tert-butyl-5-[(6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methylsulfanyl]-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-tert-butyl-5-[(6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methylthio]-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-tert-butyl-5-[(6-ethyl-7-hydroxy-2-oxochromen-4-yl)methylsulfanyl]-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 7-tert-butyl-5-[(6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methylthio]-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C24H26N4O5S MolecularWeight: 482.55204

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC(=NC4=C3C(=O)N(C(=O)N4C)C)C(C)(C)C)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC(=NC4=C3C(=O)N(C(=O)N4C)C)C(C)(C)C)O

InChI

InChI=1S/C24H26N4O5S/c1-7-12-8-14-13(9-17(30)33-16(14)10-15(12)29)11-34-20-18-19(25-22(26-20)24(2,3)4)27(5)23(32)28(6)21(18)31/h8-10,29H,7,11H2,1-6H3