2-methyl-4,6-bis(octylsulfanylmethyl)phenol; 2-methyl-4,6-bis(2,4,4-trimethylpentan-2-ylsulfanylmethyl)phenol

Systemtic Name: 2-methyl-4,6-bis(octylsulfanylmethyl)phenol; 2-methyl-4,6-bis(2,4,4-trimethylpentan-2-ylsulfanylmethyl)phenol Openeye Name: 2-methyl-4,6-bis(octylsulfanylmethyl)phenol; 2-methyl-4,6-bis(1,1,3,3-tetramethylbutylsulfanylmethyl)phenol CAS Name: 2-methyl-4,6-bis[(octylthio)methyl]phenol; 2-methyl-4,6-bis[(2,4,4-trimethylpentan-2-ylthio)methyl]phenol IUPAC Name: 2-methyl-4,6-bis(octylsulfanylmethyl)phenol; 2-methyl-4,6-bis(2,4,4-trimethylpentan-2-ylsulfanylmethyl)phenol Traditional Name: 2-methyl-4,6-bis[(octylthio)methyl]phenol; 2-methyl-4,6-bis[(1,1,3,3-tetramethylbutylthio)methyl]phenol Formula: C50H88O2S4 MolecularWeight: 849.49252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSCC1=CC(=C(C(=C1)CSCCCCCCCC)O)C.CC1=C(C(=CC(=C1)CSC(C)(C)CC(C)(C)C)CSC(C)(C)CC(C)(C)C)O

Isomeric SMILES

CCCCCCCCSCC1=CC(=C(C(=C1)CSCCCCCCCC)O)C.CC1=C(C(=CC(=C1)CSC(C)(C)CC(C)(C)C)CSC(C)(C)CC(C)(C)C)O

InChI

InChI=1S/2C25H44OS2/c1-18-12-19(14-27-24(8,9)16-22(2,3)4)13-20(21(18)26)15-28-25(10,11)17-23(5,6)7;1-4-6-8-10-12-14-16-27-20-23-18-22(3)25(26)24(19-23)21-28-17-15-13-11-9-7-5-2/h12-13,26H,14-17H2,1-11H3;18-19,26H,4-17,20-21H2,1-3H3