2-[[bis(2-pyridin-2-ylethyl)amino]methyl]-4-tert-butyl-6-methylsulfanyl-phenol

Systemtic Name: 2-[[bis(2-pyridin-2-ylethyl)amino]methyl]-4-tert-butyl-6-methylsulfanyl-phenol Openeye Name: 2-[[bis[2-(2-pyridyl)ethyl]amino]methyl]-4-tert-butyl-6-methylsulfanyl-phenol CAS Name: 2-[[bis[2-(2-pyridinyl)ethyl]amino]methyl]-4-tert-butyl-6-(methylthio)phenol IUPAC Name: 2-[[bis(2-pyridin-2-ylethyl)amino]methyl]-4-tert-butyl-6-methylsulfanylphenol Traditional Name: 2-[[bis[2-(2-pyridyl)ethyl]amino]methyl]-4-tert-butyl-6-(methylthio)phenol Formula: C26H33N3OS MolecularWeight: 435.62472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)SC)O)CN(CCC2=CC=CC=N2)CCC3=CC=CC=N3

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)SC)O)CN(CCC2=CC=CC=N2)CCC3=CC=CC=N3

InChI

InChI=1S/C26H33N3OS/c1-26(2,3)21-17-20(25(30)24(18-21)31-4)19-29(15-11-22-9-5-7-13-27-22)16-12-23-10-6-8-14-28-23/h5-10,13-14,17-18,30H,11-12,15-16,19H2,1-4H3