3-(6-aminopurin-9-yl)-1-(4-fluorophenyl)propan-1-one

Systemtic Name: 3-(6-aminopurin-9-yl)-1-(4-fluorophenyl)propan-1-one Openeye Name: 3-(6-aminopurin-9-yl)-1-(4-fluorophenyl)propan-1-one CAS Name: 3-(6-aminopurin-9-yl)-1-(4-fluorophenyl)-1-propanone IUPAC Name: 3-(6-aminopurin-9-yl)-1-(4-fluorophenyl)propan-1-one Traditional Name: 3-adenin-9-yl-1-(4-fluorophenyl)propan-1-one Formula: C14H12FN5O MolecularWeight: 285.276383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCN2C=NC3=C2N=CN=C3N)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCN2C=NC3=C2N=CN=C3N)F

InChI

InChI=1S/C14H12FN5O/c15-10-3-1-9(2-4-10)11(21)5-6-20-8-19-12-13(16)17-7-18-14(12)20/h1-4,7-8H,5-6H2,(H2,16,17,18)