4,7-dimethyl-6-(3-methylphenyl)purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4,7-dimethyl-6-(3-methylphenyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 4,7-dimethyl-6-(m-tolyl)purino[7,8-a]imidazole-1,3-dione CAS Name: 4,7-dimethyl-6-(3-methylphenyl)purino[7,8-a]imidazole-1,3-dione IUPAC Name: 4,7-dimethyl-6-(3-methylphenyl)purino[7,8-a]imidazole-1,3-dione Traditional Name: 4,7-dimethyl-6-(m-tolyl)purin[7,8-a]imidazole-1,3-quinone Formula: C16H15N5O2 MolecularWeight: 309.3226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CN3C2=NC4=C3C(=O)NC(=O)N4C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CN3C2=NC4=C3C(=O)NC(=O)N4C)C

InChI

InChI=1S/C16H15N5O2/c1-9-5-4-6-11(7-9)21-10(2)8-20-12-13(17-15(20)21)19(3)16(23)18-14(12)22/h4-8H,1-3H3,(H,18,22,23)