2-[(4-dodecylphenyl)methyl]tridecane-1-thiol

Systemtic Name: 2-[(4-dodecylphenyl)methyl]tridecane-1-thiol Openeye Name: 2-[(4-dodecylphenyl)methyl]tridecane-1-thiol CAS Name: 2-[(4-dodecylphenyl)methyl]-1-tridecanethiol IUPAC Name: 2-[(4-dodecylphenyl)methyl]tridecane-1-thiol Traditional Name: 2-(4-laurylbenzyl)tridecane-1-thiol Formula: C32H58S MolecularWeight: 474.86792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)CC(CCCCCCCCCCC)CS

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)CC(CCCCCCCCCCC)CS

InChI

InChI=1S/C32H58S/c1-3-5-7-9-11-13-15-16-18-20-22-30-24-26-31(27-25-30)28-32(29-33)23-21-19-17-14-12-10-8-6-4-2/h24-27,32-33H,3-23,28-29H2,1-2H3