2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(2-quinolin-8-ylethyl)ethanamide

Systemtic Name: 2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(2-quinolin-8-ylethyl)ethanamide Openeye Name: 2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)-N-[2-(8-quinolyl)ethyl]acetamide CAS Name: 2-(3,7-dimethyl-2,6-dioxo-1-purinyl)-N-[2-(8-quinolinyl)ethyl]acetamide IUPAC Name: 2-(3,7-dimethyl-2,6-dioxopurin-1-yl)-N-(2-quinolin-8-ylethyl)acetamide Traditional Name: 2-(2,6-diketo-3,7-dimethyl-purin-1-yl)-N-[2-(8-quinolyl)ethyl]acetamide Formula: C20H20N6O3 MolecularWeight: 392.4112

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)NCCC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)NCCC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C20H20N6O3/c1-24-12-23-18-17(24)19(28)26(20(29)25(18)2)11-15(27)21-10-8-14-6-3-5-13-7-4-9-22-16(13)14/h3-7,9,12H,8,10-11H2,1-2H3,(H,21,27)