9-[(7-methoxy-4-oxidanylidene-quinazolin-3-yl)methyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 9-[(7-methoxy-4-oxidanylidene-quinazolin-3-yl)methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 9-[(7-methoxy-4-oxo-quinazolin-3-yl)methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 9-[(7-methoxy-4-oxo-3-quinazolinyl)methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 9-[(7-methoxy-4-oxoquinazolin-3-yl)methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 9-[(4-keto-7-methoxy-quinazolin-3-yl)methyl]-1,3-dimethyl-xanthine Formula: C17H16N6O4 MolecularWeight: 368.34674

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N=CN2CN3C=NC4=C(C3=O)C=CC(=C4)OC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N=CN2CN3C=NC4=C(C3=O)C=CC(=C4)OC

InChI

InChI=1S/C17H16N6O4/c1-20-14-13(16(25)21(2)17(20)26)19-8-22(14)9-23-7-18-12-6-10(27-3)4-5-11(12)15(23)24/h4-8H,9H2,1-3H3