(E)-N-(3-pyridin-2-ylsulfanylpropyl)octadec-9-enamide

Systemtic Name: (E)-N-(3-pyridin-2-ylsulfanylpropyl)octadec-9-enamide Openeye Name: (E)-N-[3-(2-pyridylsulfanyl)propyl]octadec-9-enamide CAS Name: (E)-N-[3-(2-pyridinylthio)propyl]-9-octadecenamide IUPAC Name: (E)-N-(3-pyridin-2-ylsulfanylpropyl)octadec-9-enamide Traditional Name: (E)-N-[3-(2-pyridylthio)propyl]octadec-9-enamide Formula: C26H44N2OS MolecularWeight: 432.70536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NCCCSC1=CC=CC=N1

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)NCCCSC1=CC=CC=N1

InChI

InChI=1S/C26H44N2OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-25(29)27-23-19-24-30-26-21-17-18-22-28-26/h9-10,17-18,21-22H,2-8,11-16,19-20,23-24H2,1H3,(H,27,29)/b10-9+