8-[2-(2-fluoranylphenoxy)ethylsulfanyl]-7H-purin-6-amine

Systemtic Name: 8-[2-(2-fluoranylphenoxy)ethylsulfanyl]-7H-purin-6-amine Openeye Name: 8-[2-(2-fluorophenoxy)ethylsulfanyl]-7H-purin-6-amine CAS Name: 8-[2-(2-fluorophenoxy)ethylthio]-7H-purin-6-amine IUPAC Name: 8-[2-(2-fluorophenoxy)ethylsulfanyl]-7H-purin-6-amine Traditional Name: [8-[2-(2-fluorophenoxy)ethylthio]-7H-purin-6-yl]amine Formula: C13H12FN5OS MolecularWeight: 305.330683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCCSC2=NC3=C(N2)C(=NC=N3)N)F

Isomeric SMILES

C1=CC=C(C(=C1)OCCSC2=NC3=C(N2)C(=NC=N3)N)F

InChI

InChI=1S/C13H12FN5OS/c14-8-3-1-2-4-9(8)20-5-6-21-13-18-10-11(15)16-7-17-12(10)19-13/h1-4,7H,5-6H2,(H3,15,16,17,18,19)