7-[(4-chlorophenyl)methyl]-1,3-dimethyl-8-(2-morpholin-4-ylethylamino)purine-2,6-dione

Systemtic Name: 7-[(4-chlorophenyl)methyl]-1,3-dimethyl-8-(2-morpholin-4-ylethylamino)purine-2,6-dione Openeye Name: 7-[(4-chlorophenyl)methyl]-1,3-dimethyl-8-(2-morpholinoethylamino)purine-2,6-dione CAS Name: 7-[(4-chlorophenyl)methyl]-1,3-dimethyl-8-[2-(4-morpholinyl)ethylamino]purine-2,6-dione IUPAC Name: 7-[(4-chlorophenyl)methyl]-1,3-dimethyl-8-(2-morpholin-4-ylethylamino)purine-2,6-dione Traditional Name: 7-(4-chlorobenzyl)-1,3-dimethyl-8-(2-morpholinoethylamino)xanthine Formula: C20H25ClN6O3 MolecularWeight: 432.9039

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCN3CCOCC3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCN3CCOCC3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H25ClN6O3/c1-24-17-16(18(28)25(2)20(24)29)27(13-14-3-5-15(21)6-4-14)19(23-17)22-7-8-26-9-11-30-12-10-26/h3-6H,7-13H2,1-2H3,(H,22,23)