2-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]phenoxy]-N-pyridin-2-yl-ethanamide

Systemtic Name: 2-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]phenoxy]-N-pyridin-2-yl-ethanamide Openeye Name: 2-[4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)phenoxy]-N-(2-pyridyl)acetamide CAS Name: 2-[4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)phenoxy]-N-(2-pyridinyl)acetamide IUPAC Name: 2-[4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)phenoxy]-N-pyridin-2-ylacetamide Traditional Name: 2-[4-(2,6-diketo-1,3-dimethyl-7H-purin-8-yl)phenoxy]-N-(2-pyridyl)acetamide Formula: C20H18N6O4 MolecularWeight: 406.39472

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC=C(C=C3)OCC(=O)NC4=CC=CC=N4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC=C(C=C3)OCC(=O)NC4=CC=CC=N4

InChI

InChI=1S/C20H18N6O4/c1-25-18-16(19(28)26(2)20(25)29)23-17(24-18)12-6-8-13(9-7-12)30-11-15(27)22-14-5-3-4-10-21-14/h3-10H,11H2,1-2H3,(H,23,24)(H,21,22,27)