9-[3-oxidanylidene-3-(2-phenylimidazol-1-yl)propyl]-3H-purin-6-one

Systemtic Name: 9-[3-oxidanylidene-3-(2-phenylimidazol-1-yl)propyl]-3H-purin-6-one Openeye Name: 9-[3-oxo-3-(2-phenylimidazol-1-yl)propyl]-3H-purin-6-one CAS Name: 9-[3-oxo-3-(2-phenyl-1-imidazolyl)propyl]-3H-purin-6-one IUPAC Name: 9-[3-oxo-3-(2-phenylimidazol-1-yl)propyl]-3H-purin-6-one Traditional Name: 9-[3-keto-3-(2-phenylimidazol-1-yl)propyl]-3H-purin-6-one Formula: C17H14N6O2 MolecularWeight: 334.33206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC=CN2C(=O)CCN3C=NC4=C3NC=NC4=O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC=CN2C(=O)CCN3C=NC4=C3NC=NC4=O

InChI

InChI=1S/C17H14N6O2/c24-13(23-9-7-18-15(23)12-4-2-1-3-5-12)6-8-22-11-21-14-16(22)19-10-20-17(14)25/h1-5,7,9-11H,6,8H2,(H,19,20,25)