2,6-bis(2-methylbutan-2-yl)-4-[prop-2-ynylsulfanyl(sulfanyl)methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 2,6-bis(2-methylbutan-2-yl)-4-[prop-2-ynylsulfanyl(sulfanyl)methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 2,6-bis(1,1-dimethylpropyl)-4-[prop-2-ynylsulfanyl(sulfanyl)methylene]cyclohexa-2,5-dien-1-one CAS Name: 4-[mercapto-(prop-2-ynylthio)methylidene]-2,6-bis(2-methylbutan-2-yl)-1-cyclohexa-2,5-dienone IUPAC Name: 2,6-bis(2-methylbutan-2-yl)-4-[prop-2-ynylsulfanyl(sulfanyl)methylidene]cyclohexa-2,5-dien-1-one Traditional Name: 2,6-ditert-amyl-4-[mercapto-(propargylthio)methylene]cyclohexa-2,5-dien-1-one Formula: C20H28OS2 MolecularWeight: 348.56572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28OS2/c1-8-11-23-18(22)14-12-15(19(4,5)9-2)17(21)16(13-14)20(6,7)10-3/h1,12-13,22H,9-11H2,2-7H3