2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-9-yl]-N-(3-morpholin-4-ylcarbonylphenyl)ethanamide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-9-yl]-N-(3-morpholin-4-ylcarbonylphenyl)ethanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-9-yl)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-9-purinyl)-N-[3-[4-morpholinyl(oxo)methyl]phenyl]acetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-9-yl)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-9-yl)-N-[3-(morpholine-4-carbonyl)phenyl]acetamide Formula: C20H22N6O5 MolecularWeight: 426.42588

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N=CN2CC(=O)NC3=CC=CC(=C3)C(=O)N4CCOCC4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N=CN2CC(=O)NC3=CC=CC(=C3)C(=O)N4CCOCC4

InChI

InChI=1S/C20H22N6O5/c1-23-17-16(19(29)24(2)20(23)30)21-12-26(17)11-15(27)22-14-5-3-4-13(10-14)18(28)25-6-8-31-9-7-25/h3-5,10,12H,6-9,11H2,1-2H3,(H,22,27)