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2,6-bis(methylsulfanyl)-4-pentacontyl-phenol

2,6-bis(methylsulfanyl)-4-pentacontyl-phenol

Systemtic Name:2,6-bis(methylsulfanyl)-4-pentacontyl-phenol
Openeye Name:2,6-bis(methylsulfanyl)-4-pentacontyl-phenol
CAS Name:2,6-bis(methylthio)-4-pentacontylphenol
IUPAC Name:2,6-bis(methylsulfanyl)-4-pentacontylphenol
Traditional Name:2,6-bis(methylthio)-4-pentacontyl-phenol
Formula: C58H110OS2
MolecularWeight: 887.6234
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC1=CC(=C(C(=C1)SC)O)SC


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC1=CC(=C(C(=C1)SC)O)SC


InChI

InChI=1S/C58H110OS2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-41-42-43-44-45-46-47-48-49-50-51-52-55-53-56(60-2)58(59)57(54-55)61-3/h53-54,59H,4-52H2,1-3H3


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