2,6-ditert-butyl-4-[[4-fluoranyl-2-(trifluoromethyl)phenyl]methylsulfanyl]phenol

Systemtic Name: 2,6-ditert-butyl-4-[[4-fluoranyl-2-(trifluoromethyl)phenyl]methylsulfanyl]phenol Openeye Name: 2,6-ditert-butyl-4-[[4-fluoro-2-(trifluoromethyl)phenyl]methylsulfanyl]phenol CAS Name: 2,6-ditert-butyl-4-[[4-fluoro-2-(trifluoromethyl)phenyl]methylthio]phenol IUPAC Name: 2,6-ditert-butyl-4-[[4-fluoro-2-(trifluoromethyl)phenyl]methylsulfanyl]phenol Traditional Name: 2,6-ditert-butyl-4-[[4-fluoro-2-(trifluoromethyl)benzyl]thio]phenol Formula: C22H26F4OS MolecularWeight: 414.499853

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SCC2=C(C=C(C=C2)F)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SCC2=C(C=C(C=C2)F)C(F)(F)F

InChI

InChI=1S/C22H26F4OS/c1-20(2,3)17-10-15(11-18(19(17)27)21(4,5)6)28-12-13-7-8-14(23)9-16(13)22(24,25)26/h7-11,27H,12H2,1-6H3