1-[tris(4-methylphenyl)methylsulfanyl]heptan-4-ol

Systemtic Name: 1-[tris(4-methylphenyl)methylsulfanyl]heptan-4-ol Openeye Name: 1-(tris-p-tolylmethylsulfanyl)heptan-4-ol CAS Name: 1-[tris(4-methylphenyl)methylthio]-4-heptanol IUPAC Name: 1-[tris(4-methylphenyl)methylsulfanyl]heptan-4-ol Traditional Name: 1-(tris-p-tolylmethylthio)heptan-4-ol Formula: C29H36OS MolecularWeight: 432.66054

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCCSC(C1=CC=C(C=C1)C)(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C)O

Isomeric SMILES

CCCC(CCCSC(C1=CC=C(C=C1)C)(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C)O

InChI

InChI=1S/C29H36OS/c1-5-7-28(30)8-6-21-31-29(25-15-9-22(2)10-16-25,26-17-11-23(3)12-18-26)27-19-13-24(4)14-20-27/h9-20,28,30H,5-8,21H2,1-4H3