3-hexylsulfanyl-3-octylsulfanyl-6-phenyl-cyclohexa-1,4-diene

Systemtic Name: 3-hexylsulfanyl-3-octylsulfanyl-6-phenyl-cyclohexa-1,4-diene Openeye Name: 3-hexylsulfanyl-3-octylsulfanyl-6-phenyl-cyclohexa-1,4-diene CAS Name: 3-(hexylthio)-3-(octylthio)-6-phenylcyclohexa-1,4-diene IUPAC Name: 3-hexylsulfanyl-3-octylsulfanyl-6-phenylcyclohexa-1,4-diene Traditional Name: 3-(hexylthio)-3-(octylthio)-6-phenyl-cyclohexa-1,4-diene Formula: C26H40S2 MolecularWeight: 416.7258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1(C=CC(C=C1)C2=CC=CC=C2)SCCCCCC

Isomeric SMILES

CCCCCCCCSC1(C=CC(C=C1)C2=CC=CC=C2)SCCCCCC

InChI

InChI=1S/C26H40S2/c1-3-5-7-9-10-15-23-28-26(27-22-14-8-6-4-2)20-18-25(19-21-26)24-16-12-11-13-17-24/h11-13,16-21,25H,3-10,14-15,22-23H2,1-2H3