N-(3-pyridin-4-ylsulfanylpropyl)octadecanamide

Systemtic Name: N-(3-pyridin-4-ylsulfanylpropyl)octadecanamide Openeye Name: N-[3-(4-pyridylsulfanyl)propyl]octadecanamide CAS Name: N-[3-(pyridin-4-ylthio)propyl]octadecanamide IUPAC Name: N-(3-pyridin-4-ylsulfanylpropyl)octadecanamide Traditional Name: N-[3-(4-pyridylthio)propyl]stearamide Formula: C26H46N2OS MolecularWeight: 434.72124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCCCSC1=CC=NC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCCCSC1=CC=NC=C1

InChI

InChI=1S/C26H46N2OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-26(29)28-21-17-24-30-25-19-22-27-23-20-25/h19-20,22-23H,2-18,21,24H2,1H3,(H,28,29)