1,2,3,4,5,6-hexakis[(4-hexylcyclohexyl)methylsulfanyl]benzene

Systemtic Name: 1,2,3,4,5,6-hexakis[(4-hexylcyclohexyl)methylsulfanyl]benzene Openeye Name: 1,2,3,4,5,6-hexakis[(4-hexylcyclohexyl)methylsulfanyl]benzene CAS Name: 1,2,3,4,5,6-hexakis[(4-hexylcyclohexyl)methylthio]benzene IUPAC Name: 1,2,3,4,5,6-hexakis[(4-hexylcyclohexyl)methylsulfanyl]benzene Traditional Name: 1,2,3,4,5,6-hexakis[(4-hexylcyclohexyl)methylthio]benzene Formula: C84H150S6 MolecularWeight: 1352.4798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)CSC2=C(C(=C(C(=C2SCC3CCC(CC3)CCCCCC)SCC4CCC(CC4)CCCCCC)SCC5CCC(CC5)CCCCCC)SCC6CCC(CC6)CCCCCC)SCC7CCC(CC7)CCCCCC

Isomeric SMILES

CCCCCCC1CCC(CC1)CSC2=C(C(=C(C(=C2SCC3CCC(CC3)CCCCCC)SCC4CCC(CC4)CCCCCC)SCC5CCC(CC5)CCCCCC)SCC6CCC(CC6)CCCCCC)SCC7CCC(CC7)CCCCCC

InChI

InChI=1S/C84H150S6/c1-7-13-19-25-31-67-37-49-73(50-38-67)61-85-79-80(86-62-74-51-39-68(40-52-74)32-26-20-14-8-2)82(88-64-76-55-43-70(44-56-76)34-28-22-16-10-4)84(90-66-78-59-47-72(48-60-78)36-30-24-18-12-6)83(89-65-77-57-45-71(46-58-77)35-29-23-17-11-5)81(79)87-63-75-53-41-69(42-54-75)33-27-21-15-9-3/h67-78H,7-66H2,1-6H3