1-[(3-fluorophenyl)methyl]-4-(7H-purin-6-yl)piperazin-2-one

Systemtic Name: 1-[(3-fluorophenyl)methyl]-4-(7H-purin-6-yl)piperazin-2-one Openeye Name: 1-[(3-fluorophenyl)methyl]-4-(7H-purin-6-yl)piperazin-2-one CAS Name: 1-[(3-fluorophenyl)methyl]-4-(7H-purin-6-yl)-2-piperazinone IUPAC Name: 1-[(3-fluorophenyl)methyl]-4-(7H-purin-6-yl)piperazin-2-one Traditional Name: 1-(3-fluorobenzyl)-4-(7H-purin-6-yl)piperazin-2-one Formula: C16H15FN6O MolecularWeight: 326.328303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1C2=NC=NC3=C2NC=N3)CC4=CC(=CC=C4)F

Isomeric SMILES

C1CN(C(=O)CN1C2=NC=NC3=C2NC=N3)CC4=CC(=CC=C4)F

InChI

InChI=1S/C16H15FN6O/c17-12-3-1-2-11(6-12)7-22-4-5-23(8-13(22)24)16-14-15(19-9-18-14)20-10-21-16/h1-3,6,9-10H,4-5,7-8H2,(H,18,19,20,21)