N'-[9-(2-hydroxyethyloxymethyl)-6-oxidanylidene-3H-purin-2-yl]-N-methyl-propanediamide

Systemtic Name: N'-[9-(2-hydroxyethyloxymethyl)-6-oxidanylidene-3H-purin-2-yl]-N-methyl-propanediamide Openeye Name: N'-[9-(2-hydroxyethoxymethyl)-6-oxo-3H-purin-2-yl]-N-methyl-propanediamide CAS Name: N'-[9-(2-hydroxyethoxymethyl)-6-oxo-3H-purin-2-yl]-N-methylpropanediamide IUPAC Name: N'-[9-(2-hydroxyethoxymethyl)-6-oxo-3H-purin-2-yl]-N-methylpropanediamide Traditional Name: N'-[9-(2-hydroxyethoxymethyl)-6-keto-3H-purin-2-yl]-N-methyl-malonamide Formula: C12H16N6O5 MolecularWeight: 324.29264

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CC(=O)NC1=NC(=O)C2=C(N1)N(C=N2)COCCO

Isomeric SMILES

CNC(=O)CC(=O)NC1=NC(=O)C2=C(N1)N(C=N2)COCCO

InChI

InChI=1S/C12H16N6O5/c1-13-7(20)4-8(21)15-12-16-10-9(11(22)17-12)14-5-18(10)6-23-3-2-19/h5,19H,2-4,6H2,1H3,(H,13,20)(H2,15,16,17,21,22)