2-[1,3-diethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanenitrile

Systemtic Name: 2-[1,3-diethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanenitrile Openeye Name: 2-(1,3-diethyl-2,6-dioxo-purin-7-yl)acetonitrile CAS Name: 2-(1,3-diethyl-2,6-dioxo-7-purinyl)acetonitrile IUPAC Name: 2-(1,3-diethyl-2,6-dioxopurin-7-yl)acetonitrile Traditional Name: 2-(1,3-diethyl-2,6-diketo-purin-7-yl)acetonitrile Formula: C11H13N5O2 MolecularWeight: 247.25322

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N(C1=O)CC)N(C=N2)CC#N

Isomeric SMILES

CCN1C2=C(C(=O)N(C1=O)CC)N(C=N2)CC#N

InChI

InChI=1S/C11H13N5O2/c1-3-15-9-8(14(6-5-12)7-13-9)10(17)16(4-2)11(15)18/h7H,3-4,6H2,1-2H3