4-dodecylsulfanyl-2,5-dimethyl-3-(phenylmethyl)phenol

Systemtic Name: 4-dodecylsulfanyl-2,5-dimethyl-3-(phenylmethyl)phenol Openeye Name: 3-benzyl-4-dodecylsulfanyl-2,5-dimethyl-phenol CAS Name: 4-(dodecylthio)-2,5-dimethyl-3-(phenylmethyl)phenol IUPAC Name: 3-benzyl-4-dodecylsulfanyl-2,5-dimethylphenol Traditional Name: 3-benzyl-4-(laurylthio)-2,5-dimethyl-phenol Formula: C27H40OS MolecularWeight: 412.6709

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC1=C(C(=C(C=C1C)O)C)CC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCSC1=C(C(=C(C=C1C)O)C)CC2=CC=CC=C2

InChI

InChI=1S/C27H40OS/c1-4-5-6-7-8-9-10-11-12-16-19-29-27-22(2)20-26(28)23(3)25(27)21-24-17-14-13-15-18-24/h13-15,17-18,20,28H,4-12,16,19,21H2,1-3H3