1,3,5-tris(2-methylundecan-2-ylsulfanyl)benzene

Systemtic Name: 1,3,5-tris(2-methylundecan-2-ylsulfanyl)benzene Openeye Name: 1,3,5-tris(1,1-dimethyldecylsulfanyl)benzene CAS Name: 1,3,5-tris(2-methylundecan-2-ylthio)benzene IUPAC Name: 1,3,5-tris(2-methylundecan-2-ylsulfanyl)benzene Traditional Name: 1,3,5-tris(1,1-dimethyldecylthio)benzene Formula: C42H78S3 MolecularWeight: 679.26372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C)(C)SC1=CC(=CC(=C1)SC(C)(C)CCCCCCCCC)SC(C)(C)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCC(C)(C)SC1=CC(=CC(=C1)SC(C)(C)CCCCCCCCC)SC(C)(C)CCCCCCCCC

InChI

InChI=1S/C42H78S3/c1-10-13-16-19-22-25-28-31-40(4,5)43-37-34-38(44-41(6,7)32-29-26-23-20-17-14-11-2)36-39(35-37)45-42(8,9)33-30-27-24-21-18-15-12-3/h34-36H,10-33H2,1-9H3