3-tert-butyl-9-methyl-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione

Systemtic Name: 3-tert-butyl-9-methyl-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione Openeye Name: 3-tert-butyl-9-methyl-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione CAS Name: 3-tert-butyl-9-methyl-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione IUPAC Name: 3-tert-butyl-9-methyl-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione Traditional Name: 3-tert-butyl-9-methyl-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-quinone Formula: C12H16N6O2 MolecularWeight: 276.29444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NNC2=NC3=C(N2C1)C(=O)NC(=O)N3C

Isomeric SMILES

CC(C)(C)C1=NNC2=NC3=C(N2C1)C(=O)NC(=O)N3C

InChI

InChI=1S/C12H16N6O2/c1-12(2,3)6-5-18-7-8(13-10(18)16-15-6)17(4)11(20)14-9(7)19/h5H2,1-4H3,(H,13,16)(H,14,19,20)