9-(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 9-(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)-1,3-dimethyl-purine-2,6-dione Openeye Name: 9-(2-chloro-6,7-dimethoxy-quinazolin-4-yl)-1,3-dimethyl-purine-2,6-dione CAS Name: 9-(2-chloro-6,7-dimethoxy-4-quinazolinyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 9-(2-chloro-6,7-dimethoxyquinazolin-4-yl)-1,3-dimethylpurine-2,6-dione Traditional Name: 9-(2-chloro-6,7-dimethoxy-quinazolin-4-yl)-1,3-dimethyl-xanthine Formula: C17H15ClN6O4 MolecularWeight: 402.7918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N=CN2C3=NC(=NC4=CC(=C(C=C43)OC)OC)Cl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N=CN2C3=NC(=NC4=CC(=C(C=C43)OC)OC)Cl

InChI

InChI=1S/C17H15ClN6O4/c1-22-14-12(15(25)23(2)17(22)26)19-7-24(14)13-8-5-10(27-3)11(28-4)6-9(8)20-16(18)21-13/h5-7H,1-4H3