6-(4-chlorophenyl)-4,7,8-trimethyl-2-phenacyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(4-chlorophenyl)-4,7,8-trimethyl-2-phenacyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(4-chlorophenyl)-4,7,8-trimethyl-2-phenacyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(4-chlorophenyl)-4,7,8-trimethyl-2-phenacylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(4-chlorophenyl)-4,7,8-trimethyl-2-phenacylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(4-chlorophenyl)-4,7,8-trimethyl-2-phenacyl-purin[7,8-a]imidazole-1,3-quinone Formula: C24H20ClN5O3 MolecularWeight: 461.9003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C3=C(N=C2N1C4=CC=C(C=C4)Cl)N(C(=O)N(C3=O)CC(=O)C5=CC=CC=C5)C)C

Isomeric SMILES

CC1=C(N2C3=C(N=C2N1C4=CC=C(C=C4)Cl)N(C(=O)N(C3=O)CC(=O)C5=CC=CC=C5)C)C

InChI

InChI=1S/C24H20ClN5O3/c1-14-15(2)30-20-21(26-23(30)29(14)18-11-9-17(25)10-12-18)27(3)24(33)28(22(20)32)13-19(31)16-7-5-4-6-8-16/h4-12H,13H2,1-3H3