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

Systemtic Name: 8-butyl-2,4-dimethyl-7-phenyl-6-(phenylmethyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-benzyl-8-butyl-2,4-dimethyl-7-phenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 8-butyl-2,4-dimethyl-7-phenyl-6-(phenylmethyl)purino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-benzyl-8-butyl-2,4-dimethyl-7-phenylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-benzyl-8-butyl-2,4-dimethyl-7-phenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C26H27N5O2 MolecularWeight: 441.52488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(C2=NC3=C(N12)C(=O)N(C(=O)N3C)C)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCC1=C(N(C2=NC3=C(N12)C(=O)N(C(=O)N3C)C)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H27N5O2/c1-4-5-16-20-21(19-14-10-7-11-15-19)30(17-18-12-8-6-9-13-18)25-27-23-22(31(20)25)24(32)29(3)26(33)28(23)2/h6-15H,4-5,16-17H2,1-3H3