1,3-dimethyl-8-phenyl-6H-purino[8,9-c][1,2,4]triazole-2,4-dione

Systemtic Name: 1,3-dimethyl-8-phenyl-6H-purino[8,9-c][1,2,4]triazole-2,4-dione Openeye Name: 1,3-dimethyl-8-phenyl-6H-purino[8,9-c][1,2,4]triazole-2,4-dione CAS Name: 1,3-dimethyl-8-phenyl-6H-purino[8,9-c][1,2,4]triazole-2,4-dione IUPAC Name: 1,3-dimethyl-8-phenyl-6H-purino[8,9-c][1,2,4]triazole-2,4-dione Traditional Name: 1,3-dimethyl-8-phenyl-6H-purino[8,9-c][1,2,4]triazole-2,4-quinone Formula: C14H12N6O2 MolecularWeight: 296.28408

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N=C3N2C(=NN3)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N=C3N2C(=NN3)C4=CC=CC=C4

InChI

InChI=1S/C14H12N6O2/c1-18-11-9(12(21)19(2)14(18)22)15-13-17-16-10(20(11)13)8-6-4-3-5-7-8/h3-7H,1-2H3,(H,15,17)