2-(2-ethoxyethyl)-4-methyl-6-(3-methylphenyl)-7-phenyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 2-(2-ethoxyethyl)-4-methyl-6-(3-methylphenyl)-7-phenyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-(2-ethoxyethyl)-4-methyl-6-(m-tolyl)-7-phenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 2-(2-ethoxyethyl)-4-methyl-6-(3-methylphenyl)-7-phenylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 2-(2-ethoxyethyl)-4-methyl-6-(3-methylphenyl)-7-phenylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-(2-ethoxyethyl)-4-methyl-6-(m-tolyl)-7-phenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C25H25N5O3 MolecularWeight: 443.4977

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C(=O)C2=C(N=C3N2C=C(N3C4=CC=CC(=C4)C)C5=CC=CC=C5)N(C1=O)C

Isomeric SMILES

CCOCCN1C(=O)C2=C(N=C3N2C=C(N3C4=CC=CC(=C4)C)C5=CC=CC=C5)N(C1=O)C

InChI

InChI=1S/C25H25N5O3/c1-4-33-14-13-28-23(31)21-22(27(3)25(28)32)26-24-29(21)16-20(18-10-6-5-7-11-18)30(24)19-12-8-9-17(2)15-19/h5-12,15-16H,4,13-14H2,1-3H3