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2-tert-butyl-4,6-bis(icosylsulfanylmethyl)phenol

2-tert-butyl-4,6-bis(icosylsulfanylmethyl)phenol

Systemtic Name:2-tert-butyl-4,6-bis(icosylsulfanylmethyl)phenol
Openeye Name:2-tert-butyl-4,6-bis(icosylsulfanylmethyl)phenol
CAS Name:2-tert-butyl-4,6-bis[(eicosylthio)methyl]phenol
IUPAC Name:2-tert-butyl-4,6-bis(icosylsulfanylmethyl)phenol
Traditional Name:2,4-bis[(arachylthio)methyl]-6-tert-butyl-phenol
Formula: C52H98OS2
MolecularWeight: 803.46392
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCSCC1=CC(=C(C(=C1)C(C)(C)C)O)CSCCCCCCCCCCCCCCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCSCC1=CC(=C(C(=C1)C(C)(C)C)O)CSCCCCCCCCCCCCCCCCCCCC


InChI

InChI=1S/C52H98OS2/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-54-46-48-44-49(51(53)50(45-48)52(3,4)5)47-55-43-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h44-45,53H,6-43,46-47H2,1-5H3


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