4-[3,5-bis(2-methylbutan-2-yl)-4-oxidanyl-phenyl]-5-(phenylmethylsulfanyl)-1,2-dithiole-3-thione

Systemtic Name: 4-[3,5-bis(2-methylbutan-2-yl)-4-oxidanyl-phenyl]-5-(phenylmethylsulfanyl)-1,2-dithiole-3-thione Openeye Name: 5-benzylsulfanyl-4-[3,5-bis(1,1-dimethylpropyl)-4-hydroxy-phenyl]dithiole-3-thione CAS Name: 4-[4-hydroxy-3,5-bis(2-methylbutan-2-yl)phenyl]-5-(phenylmethylthio)-3-dithiolethione IUPAC Name: 5-benzylsulfanyl-4-[4-hydroxy-3,5-bis(2-methylbutan-2-yl)phenyl]dithiole-3-thione Traditional Name: 5-(benzylthio)-4-(3,5-ditert-amyl-4-hydroxy-phenyl)dithiole-3-thione Formula: C26H32OS4 MolecularWeight: 488.79168

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CC)C2=C(SSC2=S)SCC3=CC=CC=C3

Isomeric SMILES

CCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CC)C2=C(SSC2=S)SCC3=CC=CC=C3

InChI

InChI=1S/C26H32OS4/c1-7-25(3,4)19-14-18(15-20(22(19)27)26(5,6)8-2)21-23(28)30-31-24(21)29-16-17-12-10-9-11-13-17/h9-15,27H,7-8,16H2,1-6H3