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

Systemtic Name: 2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]propanediamide Openeye Name: 2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)propanediamide CAS Name: 2-(3,7-dimethyl-2,6-dioxo-1-purinyl)propanediamide IUPAC Name: 2-(3,7-dimethyl-2,6-dioxopurin-1-yl)propanediamide Traditional Name: 2-(2,6-diketo-3,7-dimethyl-purin-1-yl)malonamide Formula: C10H12N6O4 MolecularWeight: 280.24008

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)C(C(=O)N)C(=O)N

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)C(C(=O)N)C(=O)N

InChI

InChI=1S/C10H12N6O4/c1-14-3-13-8-5(14)9(19)16(10(20)15(8)2)4(6(11)17)7(12)18/h3-4H,1-2H3,(H2,11,17)(H2,12,18)