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

Systemtic Name: 7-(1-adamantyl)-2,4-dimethyl-6-phenyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 7-(1-adamantyl)-2,4-dimethyl-6-phenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 7-(1-adamantyl)-2,4-dimethyl-6-phenylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 7-(1-adamantyl)-2,4-dimethyl-6-phenylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 7-(1-adamantyl)-2,4-dimethyl-6-phenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)C4=CC=CC=C4)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)C4=CC=CC=C4)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C25H27N5O2/c1-27-21-20(22(31)28(2)24(27)32)29-14-19(30(23(29)26-21)18-6-4-3-5-7-18)25-11-15-8-16(12-25)10-17(9-15)13-25/h3-7,14-17H,8-13H2,1-2H3