2-tert-butyl-4,6-bis(hexadecylsulfanylmethyl)phenol

Systemtic Name: 2-tert-butyl-4,6-bis(hexadecylsulfanylmethyl)phenol Openeye Name: 2-tert-butyl-4,6-bis(hexadecylsulfanylmethyl)phenol CAS Name: 2-tert-butyl-4,6-bis[(hexadecylthio)methyl]phenol IUPAC Name: 2-tert-butyl-4,6-bis(hexadecylsulfanylmethyl)phenol Traditional Name: 2-tert-butyl-4,6-bis[(cetylthio)methyl]phenol Formula: C44H82OS2 MolecularWeight: 691.25128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSCC1=CC(=C(C(=C1)C(C)(C)C)O)CSCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCSCC1=CC(=C(C(=C1)C(C)(C)C)O)CSCCCCCCCCCCCCCCCC

InChI

InChI=1S/C44H82OS2/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-46-38-40-36-41(43(45)42(37-40)44(3,4)5)39-47-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h36-37,45H,6-35,38-39H2,1-5H3