6-[2-(4-chloranylphenoxy)ethylsulfanyl]-7H-purine

Systemtic Name: 6-[2-(4-chloranylphenoxy)ethylsulfanyl]-7H-purine Openeye Name: 6-[2-(4-chlorophenoxy)ethylsulfanyl]-7H-purine CAS Name: 6-[2-(4-chlorophenoxy)ethylthio]-7H-purine IUPAC Name: 6-[2-(4-chlorophenoxy)ethylsulfanyl]-7H-purine Traditional Name: 6-[2-(4-chlorophenoxy)ethylthio]-7H-purine Formula: C13H11ClN4OS MolecularWeight: 306.77064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCSC2=NC=NC3=C2NC=N3)Cl

Isomeric SMILES

C1=CC(=CC=C1OCCSC2=NC=NC3=C2NC=N3)Cl

InChI

InChI=1S/C13H11ClN4OS/c14-9-1-3-10(4-2-9)19-5-6-20-13-11-12(16-7-15-11)17-8-18-13/h1-4,7-8H,5-6H2,(H,15,16,17,18)