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

Systemtic Name: 6-(2,5-dimethylphenyl)-2-hexyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(2,5-dimethylphenyl)-2-hexyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(2,5-dimethylphenyl)-2-hexyl-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(2,5-dimethylphenyl)-2-hexyl-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(2,5-dimethylphenyl)-2-hexyl-4,7-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C23H29N5O2 MolecularWeight: 407.50866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=C(N=C3N2C=C(N3C4=C(C=CC(=C4)C)C)C)N(C1=O)C

Isomeric SMILES

CCCCCCN1C(=O)C2=C(N=C3N2C=C(N3C4=C(C=CC(=C4)C)C)C)N(C1=O)C

InChI

InChI=1S/C23H29N5O2/c1-6-7-8-9-12-26-21(29)19-20(25(5)23(26)30)24-22-27(19)14-17(4)28(22)18-13-15(2)10-11-16(18)3/h10-11,13-14H,6-9,12H2,1-5H3