2,6-ditert-butyl-4-[prop-2-enylsulfanyl(sulfanyl)methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 2,6-ditert-butyl-4-[prop-2-enylsulfanyl(sulfanyl)methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[allylsulfanyl(sulfanyl)methylene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one CAS Name: 2,6-ditert-butyl-4-[mercapto-(prop-2-enylthio)methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 2,6-ditert-butyl-4-[prop-2-enylsulfanyl(sulfanyl)methylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[(allylthio)-mercapto-methylene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one Formula: C18H26OS2 MolecularWeight: 322.52844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(S)SCC=C)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(S)SCC=C)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C18H26OS2/c1-8-9-21-16(20)12-10-13(17(2,3)4)15(19)14(11-12)18(5,6)7/h8,10-11,20H,1,9H2,2-7H3