CHEBI:141532 - 4-((4,6-bis(octylthio)-1,3,5-triazin-2-yl)amino)-2,6-di-tert-butylphenol

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ChEBI Name 4-((4,6-bis(octylthio)-1,3,5-triazin-2-yl)amino)-2,6-di-tert-butylphenol
ChEBI ID CHEBI:141532
Stars This entity has been manually annotated by a third party.
Submitter Mark Williams
Supplier Information
Download Molfile XML SDF
Formula C33H56N4OS2
Net Charge 0
Average Mass 588.957
Monoisotopic Mass 588.38955
InChI InChI=1S/C33H56N4OS2/c1-9-11-13-15-17-19-21-39-30-35-29(36-31(37-30)40-22-20-18-16-14-12-10-2)34-25-23-26(32(3,4)5)28(38)27(24-25)33(6,7)8/h23-24,38H,9-22H2,1-8H3,(H,34,35,36,37)
InChIKey QRLSTWVLSWCGBT-UHFFFAOYSA-N
SMILES S(CCCCCCCC)C1=NC(N(C2=CC(C(C)(C)C)=C(O)C(C(C)(C)C)=C2)[H])=NC(SCCCCCCCC)=N1
ChEBI Ontology
Outgoing 4-((4,6-bis(octylthio)-1,3,5-triazin-2-yl)amino)-2,6-di-tert-butylphenol (CHEBI:141532) is a triazines (CHEBI:38102)
Last Modified
06 August 2018