6-[2-(phenylmethylsulfanyl)ethoxy]-5H-purine

Systemtic Name: 6-[2-(phenylmethylsulfanyl)ethoxy]-5H-purine Openeye Name: 6-(2-benzylsulfanylethoxy)-5H-purine CAS Name: 6-[2-(phenylmethylthio)ethoxy]-5H-purine IUPAC Name: 6-(2-benzylsulfanylethoxy)-5H-purine Traditional Name: 6-[2-(benzylthio)ethoxy]-5H-purine Formula: C14H14N4OS MolecularWeight: 286.35216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCOC2=NC=NC3=NC=NC32

Isomeric SMILES

C1=CC=C(C=C1)CSCCOC2=NC=NC3=NC=NC32

InChI

InChI=1S/C14H14N4OS/c1-2-4-11(5-3-1)8-20-7-6-19-14-12-13(16-9-15-12)17-10-18-14/h1-5,9-10,12H,6-8H2