4-azanyl-N-[1,3,7-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]butanamide

Systemtic Name: 4-azanyl-N-[1,3,7-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]butanamide Openeye Name: 4-amino-N-(1,3,7-trimethyl-2,6-dioxo-purin-8-yl)butanamide CAS Name: 4-amino-N-(1,3,7-trimethyl-2,6-dioxo-8-purinyl)butanamide IUPAC Name: 4-amino-N-(1,3,7-trimethyl-2,6-dioxopurin-8-yl)butanamide Traditional Name: 4-amino-N-(2,6-diketo-1,3,7-trimethyl-purin-8-yl)butyramide Formula: C12H18N6O3 MolecularWeight: 294.30972

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1NC(=O)CCCN)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CN1C2=C(N=C1NC(=O)CCCN)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C12H18N6O3/c1-16-8-9(17(2)12(21)18(3)10(8)20)15-11(16)14-7(19)5-4-6-13/h4-6,13H2,1-3H3,(H,14,15,19)