6-(2-ethylphenyl)-4-methyl-2-(naphthalen-1-ylmethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(2-ethylphenyl)-4-methyl-2-(naphthalen-1-ylmethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(2-ethylphenyl)-4-methyl-2-(1-naphthylmethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione CAS Name: 6-(2-ethylphenyl)-4-methyl-2-(1-naphthalenylmethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(2-ethylphenyl)-4-methyl-2-(naphthalen-1-ylmethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(2-ethylphenyl)-4-methyl-2-(1-naphthylmethyl)-7,8-dihydropurin[7,8-a]imidazole-1,3-quinone Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2CCN3C2=NC4=C3C(=O)N(C(=O)N4C)CC5=CC=CC6=CC=CC=C65

Isomeric SMILES

CCC1=CC=CC=C1N2CCN3C2=NC4=C3C(=O)N(C(=O)N4C)CC5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C27H25N5O2/c1-3-18-9-5-7-14-22(18)30-15-16-31-23-24(28-26(30)31)29(2)27(34)32(25(23)33)17-20-12-8-11-19-10-4-6-13-21(19)20/h4-14H,3,15-17H2,1-2H3