6-(3-ethoxypropyl)-2,4-dimethyl-7-(4-methylphenyl)purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(3-ethoxypropyl)-2,4-dimethyl-7-(4-methylphenyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(3-ethoxypropyl)-2,4-dimethyl-7-(p-tolyl)purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(3-ethoxypropyl)-2,4-dimethyl-7-(4-methylphenyl)purino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(3-ethoxypropyl)-2,4-dimethyl-7-(4-methylphenyl)purino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(3-ethoxypropyl)-2,4-dimethyl-7-(p-tolyl)purin[7,8-a]imidazole-1,3-quinone Formula: C21H25N5O3 MolecularWeight: 395.4549

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)C)C4=CC=C(C=C4)C

Isomeric SMILES

CCOCCCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)C)C4=CC=C(C=C4)C

InChI

InChI=1S/C21H25N5O3/c1-5-29-12-6-11-25-16(15-9-7-14(2)8-10-15)13-26-17-18(22-20(25)26)23(3)21(28)24(4)19(17)27/h7-10,13H,5-6,11-12H2,1-4H3