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

Systemtic Name: N-(cyanomethyl)-2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanamide Openeye Name: N-(cyanomethyl)-2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetamide CAS Name: N-(cyanomethyl)-2-(1,3-dimethyl-2,6-dioxo-7-purinyl)acetamide IUPAC Name: N-(cyanomethyl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide Traditional Name: N-(cyanomethyl)-2-(2,6-diketo-1,3-dimethyl-purin-7-yl)acetamide Formula: C11H12N6O3 MolecularWeight: 276.25138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N6O3/c1-15-9-8(10(19)16(2)11(15)20)17(6-14-9)5-7(18)13-4-3-12/h6H,4-5H2,1-2H3,(H,13,18)