4,7-dimethyl-2-(2-methylpropyl)-6H-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4,7-dimethyl-2-(2-methylpropyl)-6H-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-isobutyl-4,7-dimethyl-6H-purino[7,8-a]imidazole-1,3-dione CAS Name: 4,7-dimethyl-2-(2-methylpropyl)-6H-purino[7,8-a]imidazole-1,3-dione IUPAC Name: 4,7-dimethyl-2-(2-methylpropyl)-6H-purino[7,8-a]imidazole-1,3-dione Traditional Name: 2-isobutyl-4,7-dimethyl-6H-purin[7,8-a]imidazole-1,3-quinone Formula: C13H17N5O2 MolecularWeight: 275.30638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1)N(C(=O)N(C3=O)CC(C)C)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1)N(C(=O)N(C3=O)CC(C)C)C

InChI

InChI=1S/C13H17N5O2/c1-7(2)5-18-11(19)9-10(16(4)13(18)20)15-12-14-8(3)6-17(9)12/h6-7H,5H2,1-4H3,(H,14,15)