6-butyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-butyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-butyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-butyl-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-butyl-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-butyl-4,7-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C13H17N5O2 MolecularWeight: 275.30638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN2C1=NC3=C2C(=O)NC(=O)N3C)C

Isomeric SMILES

CCCCN1C(=CN2C1=NC3=C2C(=O)NC(=O)N3C)C

InChI

InChI=1S/C13H17N5O2/c1-4-5-6-17-8(2)7-18-9-10(14-12(17)18)16(3)13(20)15-11(9)19/h7H,4-6H2,1-3H3,(H,15,19,20)