1-[(4-chlorophenyl)methyl]-7,9-dimethyl-2-morpholin-4-yl-purine-6,8-dione

Systemtic Name: 1-[(4-chlorophenyl)methyl]-7,9-dimethyl-2-morpholin-4-yl-purine-6,8-dione Openeye Name: 1-[(4-chlorophenyl)methyl]-7,9-dimethyl-2-morpholino-purine-6,8-dione CAS Name: 1-[(4-chlorophenyl)methyl]-7,9-dimethyl-2-(4-morpholinyl)purine-6,8-dione IUPAC Name: 1-[(4-chlorophenyl)methyl]-7,9-dimethyl-2-morpholin-4-ylpurine-6,8-dione Traditional Name: 1-(4-chlorobenzyl)-7,9-dimethyl-2-morpholino-purine-6,8-quinone Formula: C18H20ClN5O3 MolecularWeight: 389.8361

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C(N(C2=O)CC3=CC=C(C=C3)Cl)N4CCOCC4)N(C1=O)C

Isomeric SMILES

CN1C2=C(N=C(N(C2=O)CC3=CC=C(C=C3)Cl)N4CCOCC4)N(C1=O)C

InChI

InChI=1S/C18H20ClN5O3/c1-21-14-15(22(2)18(21)26)20-17(23-7-9-27-10-8-23)24(16(14)25)11-12-3-5-13(19)6-4-12/h3-6H,7-11H2,1-2H3