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

Systemtic Name: 7-(1-adamantyl)-6-butyl-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 7-(1-adamantyl)-6-butyl-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 7-(1-adamantyl)-6-butyl-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 7-(1-adamantyl)-6-butyl-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 7-(1-adamantyl)-6-butyl-2,4-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C23H31N5O2 MolecularWeight: 409.52454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)C)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCCCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)C)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C23H31N5O2/c1-4-5-6-27-17(23-10-14-7-15(11-23)9-16(8-14)12-23)13-28-18-19(24-21(27)28)25(2)22(30)26(3)20(18)29/h13-16H,4-12H2,1-3H3