2-[2-[2-(6-aminopurin-9-yl)ethoxymethyl-[2-(2-hydroxyethyldisulfanyl)ethoxy]phosphoryl]oxyethyldisulfanyl]ethanol

Systemtic Name: 2-[2-[2-(6-aminopurin-9-yl)ethoxymethyl-[2-(2-hydroxyethyldisulfanyl)ethoxy]phosphoryl]oxyethyldisulfanyl]ethanol Openeye Name: 2-[2-[2-(6-aminopurin-9-yl)ethoxymethyl-[2-(2-hydroxyethyldisulfanyl)ethoxy]phosphoryl]oxyethyldisulfanyl]ethanol CAS Name: 2-[2-[2-(6-aminopurin-9-yl)ethoxymethyl-[2-(2-hydroxyethyldisulfanyl)ethoxy]phosphoryl]oxyethyldisulfanyl]ethanol IUPAC Name: 2-[2-[2-(6-aminopurin-9-yl)ethoxymethyl-[2-(2-hydroxyethyldisulfanyl)ethoxy]phosphoryl]oxyethyldisulfanyl]ethanol Traditional Name: 2-[2-[2-adenin-9-ylethoxymethyl-[2-(2-hydroxyethyldisulfanyl)ethoxy]phosphoryl]oxyethyldisulfanyl]ethanol Formula: C16H28N5O6PS4 MolecularWeight: 545.657181

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2CCOCP(=O)(OCCSSCCO)OCCSSCCO

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2CCOCP(=O)(OCCSSCCO)OCCSSCCO

InChI

InChI=1S/C16H28N5O6PS4/c17-15-14-16(19-11-18-15)21(12-20-14)1-4-25-13-28(24,26-5-9-31-29-7-2-22)27-6-10-32-30-8-3-23/h11-12,22-23H,1-10,13H2,(H2,17,18,19)