6-azanyl-9-[3-(4-fluoranylphenoxy)propyl]-7H-purine-8-thione

Systemtic Name: 6-azanyl-9-[3-(4-fluoranylphenoxy)propyl]-7H-purine-8-thione Openeye Name: 6-amino-9-[3-(4-fluorophenoxy)propyl]-7H-purine-8-thione CAS Name: 6-amino-9-[3-(4-fluorophenoxy)propyl]-7H-purine-8-thione IUPAC Name: 6-amino-9-[3-(4-fluorophenoxy)propyl]-7H-purine-8-thione Traditional Name: 6-amino-9-[3-(4-fluorophenoxy)propyl]-7H-purine-8-thione Formula: C14H14FN5OS MolecularWeight: 319.357263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCN2C3=C(C(=NC=N3)N)NC2=S)F

Isomeric SMILES

C1=CC(=CC=C1OCCCN2C3=C(C(=NC=N3)N)NC2=S)F

InChI

InChI=1S/C14H14FN5OS/c15-9-2-4-10(5-3-9)21-7-1-6-20-13-11(19-14(20)22)12(16)17-8-18-13/h2-5,8H,1,6-7H2,(H,19,22)(H2,16,17,18)