2-octadecylnaphthalene-1-thiol

Systemtic Name: 2-octadecylnaphthalene-1-thiol Openeye Name: 2-octadecylnaphthalene-1-thiol CAS Name: 2-octadecyl-1-naphthalenethiol IUPAC Name: 2-octadecylnaphthalene-1-thiol Traditional Name: 2-stearylnaphthalene-1-thiol Formula: C28H44S MolecularWeight: 412.71396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=C(C2=CC=CC=C2C=C1)S

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=C(C2=CC=CC=C2C=C1)S

InChI

InChI=1S/C28H44S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-26-24-23-25-20-18-19-22-27(25)28(26)29/h18-20,22-24,29H,2-17,21H2,1H3