2-[(2,5-dimethylphenyl)methyl]-4,7-dimethyl-6H-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 2-[(2,5-dimethylphenyl)methyl]-4,7-dimethyl-6H-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-[(2,5-dimethylphenyl)methyl]-4,7-dimethyl-6H-purino[7,8-a]imidazole-1,3-dione CAS Name: 2-[(2,5-dimethylphenyl)methyl]-4,7-dimethyl-6H-purino[7,8-a]imidazole-1,3-dione IUPAC Name: 2-[(2,5-dimethylphenyl)methyl]-4,7-dimethyl-6H-purino[7,8-a]imidazole-1,3-dione Traditional Name: 2-(2,5-dimethylbenzyl)-4,7-dimethyl-6H-purin[7,8-a]imidazole-1,3-quinone Formula: C18H19N5O2 MolecularWeight: 337.37576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2C(=O)C3=C(N=C4N3C=C(N4)C)N(C2=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2C(=O)C3=C(N=C4N3C=C(N4)C)N(C2=O)C

InChI

InChI=1S/C18H19N5O2/c1-10-5-6-11(2)13(7-10)9-23-16(24)14-15(21(4)18(23)25)20-17-19-12(3)8-22(14)17/h5-8H,9H2,1-4H3,(H,19,20)