8-(7,8-dimethoxy-1-oxidanylidene-phthalazin-2-yl)-1,3-dimethyl-7-phenethyl-purine-2,6-dione

Systemtic Name: 8-(7,8-dimethoxy-1-oxidanylidene-phthalazin-2-yl)-1,3-dimethyl-7-phenethyl-purine-2,6-dione Openeye Name: 8-(7,8-dimethoxy-1-oxo-phthalazin-2-yl)-1,3-dimethyl-7-phenethyl-purine-2,6-dione CAS Name: 8-(7,8-dimethoxy-1-oxo-2-phthalazinyl)-1,3-dimethyl-7-phenethylpurine-2,6-dione IUPAC Name: 8-(7,8-dimethoxy-1-oxophthalazin-2-yl)-1,3-dimethyl-7-phenethylpurine-2,6-dione Traditional Name: 8-(1-keto-7,8-dimethoxy-phthalazin-2-yl)-1,3-dimethyl-7-phenethyl-xanthine Formula: C25H24N6O5 MolecularWeight: 488.49526

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3C(=O)C4=C(C=CC(=C4OC)OC)C=N3)CCC5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3C(=O)C4=C(C=CC(=C4OC)OC)C=N3)CCC5=CC=CC=C5

InChI

InChI=1S/C25H24N6O5/c1-28-21-19(23(33)29(2)25(28)34)30(13-12-15-8-6-5-7-9-15)24(27-21)31-22(32)18-16(14-26-31)10-11-17(35-3)20(18)36-4/h5-11,14H,12-13H2,1-4H3