2,6-ditert-butyl-4-[[6-[(3,5-ditert-butyl-4-oxidanyl-phenyl)amino]-2-octyl-3-sulfanyl-pyridin-4-yl]amino]phenol

Systemtic Name: 2,6-ditert-butyl-4-[[6-[(3,5-ditert-butyl-4-oxidanyl-phenyl)amino]-2-octyl-3-sulfanyl-pyridin-4-yl]amino]phenol Openeye Name: 2,6-ditert-butyl-4-[[6-(3,5-ditert-butyl-4-hydroxy-anilino)-2-octyl-3-sulfanyl-4-pyridyl]amino]phenol CAS Name: 2,6-ditert-butyl-4-[[6-(3,5-ditert-butyl-4-hydroxyanilino)-3-mercapto-2-octyl-4-pyridinyl]amino]phenol IUPAC Name: 2,6-ditert-butyl-4-[[6-(3,5-ditert-butyl-4-hydroxyanilino)-2-octyl-3-sulfanylpyridin-4-yl]amino]phenol Traditional Name: 2,6-ditert-butyl-4-[[6-(3,5-ditert-butyl-4-hydroxy-anilino)-3-mercapto-2-octyl-4-pyridyl]amino]phenol Formula: C41H63N3O2S MolecularWeight: 662.02282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(=CC(=N1)NC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)NC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)S

Isomeric SMILES

CCCCCCCCC1=C(C(=CC(=N1)NC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)NC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)S

InChI

InChI=1S/C41H63N3O2S/c1-14-15-16-17-18-19-20-32-37(47)33(42-26-21-28(38(2,3)4)35(45)29(22-26)39(5,6)7)25-34(44-32)43-27-23-30(40(8,9)10)36(46)31(24-27)41(11,12)13/h21-25,45-47H,14-20H2,1-13H3,(H2,42,43,44)