3-tert-butyl-7,9-dimethyl-1-pentyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione

Systemtic Name: 3-tert-butyl-7,9-dimethyl-1-pentyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione Openeye Name: 3-tert-butyl-7,9-dimethyl-1-pentyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione CAS Name: 3-tert-butyl-7,9-dimethyl-1-pentyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione IUPAC Name: 3-tert-butyl-7,9-dimethyl-1-pentyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione Traditional Name: 1-amyl-3-tert-butyl-7,9-dimethyl-4H-purino[8,7-c][1,2,4]triazine-6,8-quinone Formula: C18H28N6O2 MolecularWeight: 360.45392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=NC3=C(N2CC(=N1)C(C)(C)C)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CCCCCN1C2=NC3=C(N2CC(=N1)C(C)(C)C)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C18H28N6O2/c1-7-8-9-10-24-16-19-14-13(15(25)22(6)17(26)21(14)5)23(16)11-12(20-24)18(2,3)4/h7-11H2,1-6H3