9-ethyl-1-(3-imidazol-1-ylpropyl)purin-6-one

Systemtic Name: 9-ethyl-1-(3-imidazol-1-ylpropyl)purin-6-one Openeye Name: 9-ethyl-1-(3-imidazol-1-ylpropyl)purin-6-one CAS Name: 9-ethyl-1-[3-(1-imidazolyl)propyl]-6-purinone IUPAC Name: 9-ethyl-1-(3-imidazol-1-ylpropyl)purin-6-one Traditional Name: 9-ethyl-1-(3-imidazol-1-ylpropyl)purin-6-one Formula: C13H16N6O MolecularWeight: 272.30574

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=CN(C2=O)CCCN3C=CN=C3

Isomeric SMILES

CCN1C=NC2=C1N=CN(C2=O)CCCN3C=CN=C3

InChI

InChI=1S/C13H16N6O/c1-2-18-9-15-11-12(18)16-10-19(13(11)20)6-3-5-17-7-4-14-8-17/h4,7-10H,2-3,5-6H2,1H3