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

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(prop-2-enylcarbamoyl)ethanamide Openeye Name: N-(allylcarbamoyl)-2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-[oxo-(prop-2-enylamino)methyl]acetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(prop-2-enylcarbamoyl)acetamide Traditional Name: N-(allylcarbamoyl)-2-(2,6-diketo-1,3-dimethyl-purin-7-yl)acetamide Formula: C13H16N6O4 MolecularWeight: 320.30394

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC(=O)NCC=C

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC(=O)NCC=C

InChI

InChI=1S/C13H16N6O4/c1-4-5-14-12(22)16-8(20)6-19-7-15-10-9(19)11(21)18(3)13(23)17(10)2/h4,7H,1,5-6H2,2-3H3,(H2,14,16,20,22)