6-(5-chloranyl-2-methoxy-phenyl)-2-ethyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(5-chloranyl-2-methoxy-phenyl)-2-ethyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(5-chloro-2-methoxy-phenyl)-2-ethyl-4,7-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(5-chloro-2-methoxyphenyl)-2-ethyl-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(5-chloro-2-methoxyphenyl)-2-ethyl-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(5-chloro-2-methoxy-phenyl)-2-ethyl-4,7-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C18H18ClN5O3 MolecularWeight: 387.82022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C3N2C=C(N3C4=C(C=CC(=C4)Cl)OC)C)N(C1=O)C

Isomeric SMILES

CCN1C(=O)C2=C(N=C3N2C=C(N3C4=C(C=CC(=C4)Cl)OC)C)N(C1=O)C

InChI

InChI=1S/C18H18ClN5O3/c1-5-22-16(25)14-15(21(3)18(22)26)20-17-23(14)9-10(2)24(17)12-8-11(19)6-7-13(12)27-4/h6-9H,5H2,1-4H3