5,7-dimethyl-1-naphthalen-1-ylcarbonyl-3-phenyl-purino[8,7-c][1,2,4]triazole-6,8-dione

Systemtic Name: 5,7-dimethyl-1-naphthalen-1-ylcarbonyl-3-phenyl-purino[8,7-c][1,2,4]triazole-6,8-dione Openeye Name: 5,7-dimethyl-1-(naphthalene-1-carbonyl)-3-phenyl-purino[8,7-c][1,2,4]triazole-6,8-dione CAS Name: 5,7-dimethyl-1-[1-naphthalenyl(oxo)methyl]-3-phenylpurino[8,7-c][1,2,4]triazole-6,8-dione IUPAC Name: 5,7-dimethyl-1-(naphthalene-1-carbonyl)-3-phenylpurino[8,7-c][1,2,4]triazole-6,8-dione Traditional Name: 5,7-dimethyl-1-(1-naphthoyl)-3-phenyl-purino[8,7-c][1,2,4]triazole-6,8-quinone Formula: C25H18N6O3 MolecularWeight: 450.44882

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3C(=NN(C3=N2)C4=CC=CC=C4)C(=O)C5=CC=CC6=CC=CC=C65

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3C(=NN(C3=N2)C4=CC=CC=C4)C(=O)C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C25H18N6O3/c1-28-21-19(23(33)29(2)25(28)34)30-22(27-31(24(30)26-21)16-11-4-3-5-12-16)20(32)18-14-8-10-15-9-6-7-13-17(15)18/h3-14H,1-2H3