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

Systemtic Name: 6-ethyl-4,7,8-trimethyl-2-[(3-methylphenyl)methyl]purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-ethyl-4,7,8-trimethyl-2-(m-tolylmethyl)purino[7,8-a]imidazole-1,3-dione CAS Name: 6-ethyl-4,7,8-trimethyl-2-[(3-methylphenyl)methyl]purino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-ethyl-4,7,8-trimethyl-2-[(3-methylphenyl)methyl]purino[7,8-a]imidazole-1,3-dione Traditional Name: 6-ethyl-4,7,8-trimethyl-2-(3-methylbenzyl)purin[7,8-a]imidazole-1,3-quinone Formula: C20H23N5O2 MolecularWeight: 365.42892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(N2C1=NC3=C2C(=O)N(C(=O)N3C)CC4=CC=CC(=C4)C)C)C

Isomeric SMILES

CCN1C(=C(N2C1=NC3=C2C(=O)N(C(=O)N3C)CC4=CC=CC(=C4)C)C)C

InChI

InChI=1S/C20H23N5O2/c1-6-23-13(3)14(4)25-16-17(21-19(23)25)22(5)20(27)24(18(16)26)11-15-9-7-8-12(2)10-15/h7-10H,6,11H2,1-5H3