3-ethyl-9-methyl-1-phenyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione

Systemtic Name: 3-ethyl-9-methyl-1-phenyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione Openeye Name: 3-ethyl-9-methyl-1-phenyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione CAS Name: 3-ethyl-9-methyl-1-phenyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione IUPAC Name: 3-ethyl-9-methyl-1-phenyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione Traditional Name: 3-ethyl-9-methyl-1-phenyl-4H-purino[8,7-c][1,2,4]triazine-6,8-quinone Formula: C16H16N6O2 MolecularWeight: 324.33724

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C2=NC3=C(N2C1)C(=O)NC(=O)N3C)C4=CC=CC=C4

Isomeric SMILES

CCC1=NN(C2=NC3=C(N2C1)C(=O)NC(=O)N3C)C4=CC=CC=C4

InChI

InChI=1S/C16H16N6O2/c1-3-10-9-21-12-13(20(2)16(24)18-14(12)23)17-15(21)22(19-10)11-7-5-4-6-8-11/h4-8H,3,9H2,1-2H3,(H,18,23,24)