2-azanyl-9-[2,3-bis(fluoranyl)-4-oxidanyl-butyl]-7,8-dihydro-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[2,3-bis(fluoranyl)-4-oxidanyl-butyl]-7,8-dihydro-3H-purin-6-one Openeye Name: 2-amino-9-(2,3-difluoro-4-hydroxy-butyl)-7,8-dihydro-3H-purin-6-one CAS Name: 2-amino-9-(2,3-difluoro-4-hydroxybutyl)-7,8-dihydro-3H-purin-6-one IUPAC Name: 2-amino-9-(2,3-difluoro-4-hydroxybutyl)-7,8-dihydro-3H-purin-6-one Traditional Name: 2-amino-9-(2,3-difluoro-4-hydroxy-butyl)-7,8-dihydro-3H-purin-6-one Formula: C9H13F2N5O2 MolecularWeight: 261.228626

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Descriptors Computed from Structure

Canonical SMILES:

C1NC2=C(N1CC(C(CO)F)F)NC(=NC2=O)N

Isomeric SMILES

C1NC2=C(N1CC(C(CO)F)F)NC(=NC2=O)N

InChI

InChI=1S/C9H13F2N5O2/c10-4(5(11)2-17)1-16-3-13-6-7(16)14-9(12)15-8(6)18/h4-5,13,17H,1-3H2,(H3,12,14,15,18)