6-(4-butylphenyl)-4-methyl-2-phenethyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(4-butylphenyl)-4-methyl-2-phenethyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(4-butylphenyl)-4-methyl-2-phenethyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione CAS Name: 6-(4-butylphenyl)-4-methyl-2-phenethyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(4-butylphenyl)-4-methyl-2-phenethyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(4-butylphenyl)-4-methyl-2-phenethyl-7,8-dihydropurin[7,8-a]imidazole-1,3-quinone Formula: C26H29N5O2 MolecularWeight: 443.54076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2CCN3C2=NC4=C3C(=O)N(C(=O)N4C)CCC5=CC=CC=C5

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2CCN3C2=NC4=C3C(=O)N(C(=O)N4C)CCC5=CC=CC=C5

InChI

InChI=1S/C26H29N5O2/c1-3-4-8-20-11-13-21(14-12-20)29-17-18-30-22-23(27-25(29)30)28(2)26(33)31(24(22)32)16-15-19-9-6-5-7-10-19/h5-7,9-14H,3-4,8,15-18H2,1-2H3