4-[[2,4-bis(fluoranyl)phenyl]methylsulfanyl-sulfanyl-methylidene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[2,4-bis(fluoranyl)phenyl]methylsulfanyl-sulfanyl-methylidene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one Openeye Name: 2,6-ditert-butyl-4-[(2,4-difluorophenyl)methylsulfanyl-sulfanyl-methylene]cyclohexa-2,5-dien-1-one CAS Name: 2,6-ditert-butyl-4-[[(2,4-difluorophenyl)methylthio]-mercaptomethylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 2,6-ditert-butyl-4-[(2,4-difluorophenyl)methylsulfanyl-sulfanylmethylidene]cyclohexa-2,5-dien-1-one Traditional Name: 2,6-ditert-butyl-4-[[(2,4-difluorobenzyl)thio]-mercapto-methylene]cyclohexa-2,5-dien-1-one Formula: C22H26F2OS2 MolecularWeight: 408.568046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(S)SCC2=C(C=C(C=C2)F)F)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(S)SCC2=C(C=C(C=C2)F)F)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C22H26F2OS2/c1-21(2,3)16-9-14(10-17(19(16)25)22(4,5)6)20(26)27-12-13-7-8-15(23)11-18(13)24/h7-11,26H,12H2,1-6H3