3,5-ditert-butyl-4-oxidanyl-2-[[4-(trifluoromethyl)phenyl]methyl]cyclohexa-2,4-diene-1-thione

Systemtic Name: 3,5-ditert-butyl-4-oxidanyl-2-[[4-(trifluoromethyl)phenyl]methyl]cyclohexa-2,4-diene-1-thione Openeye Name: 3,5-ditert-butyl-4-hydroxy-2-[[4-(trifluoromethyl)phenyl]methyl]cyclohexa-2,4-diene-1-thione CAS Name: 3,5-ditert-butyl-4-hydroxy-2-[[4-(trifluoromethyl)phenyl]methyl]-1-cyclohexa-2,4-dienethione IUPAC Name: 3,5-ditert-butyl-4-hydroxy-2-[[4-(trifluoromethyl)phenyl]methyl]cyclohexa-2,4-diene-1-thione Traditional Name: 3,5-ditert-butyl-4-hydroxy-2-[4-(trifluoromethyl)benzyl]cyclohexa-2,4-diene-1-thione Formula: C22H27F3OS MolecularWeight: 396.50939

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=C(C(=S)C1)CC2=CC=C(C=C2)C(F)(F)F)C(C)(C)C)O

Isomeric SMILES

CC(C)(C)C1=C(C(=C(C(=S)C1)CC2=CC=C(C=C2)C(F)(F)F)C(C)(C)C)O

InChI

InChI=1S/C22H27F3OS/c1-20(2,3)16-12-17(27)15(18(19(16)26)21(4,5)6)11-13-7-9-14(10-8-13)22(23,24)25/h7-10,26H,11-12H2,1-6H3