3-methyl-8-morpholin-4-yl-1,7-bis(phenylmethyl)purine-2,6-dione

Systemtic Name: 3-methyl-8-morpholin-4-yl-1,7-bis(phenylmethyl)purine-2,6-dione Openeye Name: 1,7-dibenzyl-3-methyl-8-morpholino-purine-2,6-dione CAS Name: 3-methyl-8-(4-morpholinyl)-1,7-bis(phenylmethyl)purine-2,6-dione IUPAC Name: 1,7-dibenzyl-3-methyl-8-morpholin-4-ylpurine-2,6-dione Traditional Name: 1,7-dibenzyl-3-methyl-8-morpholino-xanthine Formula: C24H25N5O3 MolecularWeight: 431.487

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)CC3=CC=CC=C3)N(C(=N2)N4CCOCC4)CC5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)CC3=CC=CC=C3)N(C(=N2)N4CCOCC4)CC5=CC=CC=C5

InChI

InChI=1S/C24H25N5O3/c1-26-21-20(22(30)29(24(26)31)17-19-10-6-3-7-11-19)28(16-18-8-4-2-5-9-18)23(25-21)27-12-14-32-15-13-27/h2-11H,12-17H2,1H3