9-(dimethylamino)-3H-purin-6-one; pentane

Systemtic Name: 9-(dimethylamino)-3H-purin-6-one; pentane Openeye Name: 9-(dimethylamino)-3H-purin-6-one; pentane CAS Name: 9-(dimethylamino)-3H-purin-6-one; pentane IUPAC Name: 9-(dimethylamino)-3H-purin-6-one; pentane Traditional Name: 9-(dimethylamino)-3H-purin-6-one; n-pentane Formula: C12H21N5O MolecularWeight: 251.32804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC.CN(C)N1C=NC2=C1NC=NC2=O

Isomeric SMILES

CCCCC.CN(C)N1C=NC2=C1NC=NC2=O

InChI

InChI=1S/C7H9N5O.C5H12/c1-11(2)12-4-10-5-6(12)8-3-9-7(5)13;1-3-5-4-2/h3-4H,1-2H3,(H,8,9,13);3-5H2,1-2H3