(6-heptylsulfanylpurin-9-yl)methanol

Systemtic Name: (6-heptylsulfanylpurin-9-yl)methanol Openeye Name: (6-heptylsulfanylpurin-9-yl)methanol CAS Name: [6-(heptylthio)-9-purinyl]methanol IUPAC Name: (6-heptylsulfanylpurin-9-yl)methanol Traditional Name: [6-(heptylthio)purin-9-yl]methanol Formula: C13H20N4OS MolecularWeight: 280.3891

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1=NC=NC2=C1N=CN2CO

Isomeric SMILES

CCCCCCCSC1=NC=NC2=C1N=CN2CO

InChI

InChI=1S/C13H20N4OS/c1-2-3-4-5-6-7-19-13-11-12(14-8-15-13)17(10-18)9-16-11/h8-9,18H,2-7,10H2,1H3