2-[2-[2-(3-octadecoxy-2-pyrimidin-2-yloxy-propyl)sulfanylethylsulfanyl]ethoxy]ethyl methanesulfonate

Systemtic Name: 2-[2-[2-(3-octadecoxy-2-pyrimidin-2-yloxy-propyl)sulfanylethylsulfanyl]ethoxy]ethyl methanesulfonate Openeye Name: 2-[2-[2-(3-octadecoxy-2-pyrimidin-2-yloxy-propyl)sulfanylethylsulfanyl]ethoxy]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[2-[2-[[3-octadecoxy-2-(2-pyrimidinyloxy)propyl]thio]ethylthio]ethoxy]ethyl ester IUPAC Name: 2-[2-[2-(3-octadecoxy-2-pyrimidin-2-yloxypropyl)sulfanylethylsulfanyl]ethoxy]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[2-[2-[[2-(2-pyrimidyloxy)-3-stearyloxy-propyl]thio]ethylthio]ethoxy]ethyl ester Formula: C32H60N2O6S3 MolecularWeight: 665.0236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(CSCCSCCOCCOS(=O)(=O)C)OC1=NC=CC=N1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(CSCCSCCOCCOS(=O)(=O)C)OC1=NC=CC=N1

InChI

InChI=1S/C32H60N2O6S3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-38-29-31(40-32-33-20-19-21-34-32)30-42-28-27-41-26-25-37-23-24-39-43(2,35)36/h19-21,31H,3-18,22-30H2,1-2H3