3,7-dihydropurin-6-one; 1-pyridin-2-ylethanone

Systemtic Name: 3,7-dihydropurin-6-one; 1-pyridin-2-ylethanone Openeye Name: 3,7-dihydropurin-6-one; 1-(2-pyridyl)ethanone CAS Name: 3,7-dihydropurin-6-one; 1-(2-pyridinyl)ethanone IUPAC Name: 3,7-dihydropurin-6-one; 1-pyridin-2-ylethanone Traditional Name: 3,7-dihydropurin-6-one; 1-(2-pyridyl)ethanone Formula: C12H11N5O2 MolecularWeight: 257.24804

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=N1.C1=NC2=C(N1)C(=O)N=CN2

Isomeric SMILES

CC(=O)C1=CC=CC=N1.C1=NC2=C(N1)C(=O)N=CN2

InChI

InChI=1S/C7H7NO.C5H4N4O/c1-6(9)7-4-2-3-5-8-7;10-5-3-4(7-1-6-3)8-2-9-5/h2-5H,1H3;1-2H,(H2,6,7,8,9,10)