2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(3-pyrrolidin-1-ylcarbonylphenyl)ethanamide

Systemtic Name: 2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(3-pyrrolidin-1-ylcarbonylphenyl)ethanamide Openeye Name: 2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)-N-[3-(pyrrolidine-1-carbonyl)phenyl]acetamide CAS Name: 2-(3,7-dimethyl-2,6-dioxo-1-purinyl)-N-[3-[oxo(1-pyrrolidinyl)methyl]phenyl]acetamide IUPAC Name: 2-(3,7-dimethyl-2,6-dioxopurin-1-yl)-N-[3-(pyrrolidine-1-carbonyl)phenyl]acetamide Traditional Name: 2-(2,6-diketo-3,7-dimethyl-purin-1-yl)-N-[3-(pyrrolidine-1-carbonyl)phenyl]acetamide Formula: C20H22N6O4 MolecularWeight: 410.42648

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)NC3=CC=CC(=C3)C(=O)N4CCCC4

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)NC3=CC=CC(=C3)C(=O)N4CCCC4

InChI

InChI=1S/C20H22N6O4/c1-23-12-21-17-16(23)19(29)26(20(30)24(17)2)11-15(27)22-14-7-5-6-13(10-14)18(28)25-8-3-4-9-25/h5-7,10,12H,3-4,8-9,11H2,1-2H3,(H,22,27)