4-[[4,6-bis(octadecylsulfanyl)-1,3,5-triazin-2-yl]amino]-2,6-ditert-butyl-phenol

Systemtic Name: 4-[[4,6-bis(octadecylsulfanyl)-1,3,5-triazin-2-yl]amino]-2,6-ditert-butyl-phenol Openeye Name: 4-[[4,6-bis(octadecylsulfanyl)-1,3,5-triazin-2-yl]amino]-2,6-ditert-butyl-phenol CAS Name: 4-[[4,6-bis(octadecylthio)-1,3,5-triazin-2-yl]amino]-2,6-ditert-butylphenol IUPAC Name: 4-[[4,6-bis(octadecylsulfanyl)-1,3,5-triazin-2-yl]amino]-2,6-ditert-butylphenol Traditional Name: 4-[[4,6-bis(stearylthio)-s-triazin-2-yl]amino]-2,6-ditert-butyl-phenol Formula: C53H96N4OS2 MolecularWeight: 869.48554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSC1=NC(=NC(=N1)NC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)SCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSC1=NC(=NC(=N1)NC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)SCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C53H96N4OS2/c1-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-59-50-55-49(54-45-43-46(52(3,4)5)48(58)47(44-45)53(6,7)8)56-51(57-50)60-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-2/h43-44,58H,9-42H2,1-8H3,(H,54,55,56,57)