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

Systemtic Name: 6-(4-butylphenyl)-4-methyl-2-(phenylmethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Openeye Name: 2-benzyl-6-(4-butylphenyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione CAS Name: 6-(4-butylphenyl)-4-methyl-2-(phenylmethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione IUPAC Name: 2-benzyl-6-(4-butylphenyl)-4-methyl-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-benzyl-6-(4-butylphenyl)-4-methyl-7,8-dihydropurin[7,8-a]imidazole-1,3-quinone Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2CCN3C2=NC4=C3C(=O)N(C(=O)N4C)CC5=CC=CC=C5

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2CCN3C2=NC4=C3C(=O)N(C(=O)N4C)CC5=CC=CC=C5

InChI

InChI=1S/C25H27N5O2/c1-3-4-8-18-11-13-20(14-12-18)28-15-16-29-21-22(26-24(28)29)27(2)25(32)30(23(21)31)17-19-9-6-5-7-10-19/h5-7,9-14H,3-4,8,15-17H2,1-2H3