N-(4-pyridin-2-ylsulfanylbutyl)octan-1-amine

Systemtic Name: N-(4-pyridin-2-ylsulfanylbutyl)octan-1-amine Openeye Name: N-[4-(2-pyridylsulfanyl)butyl]octan-1-amine CAS Name: N-[4-(2-pyridinylthio)butyl]-1-octanamine IUPAC Name: N-(4-pyridin-2-ylsulfanylbutyl)octan-1-amine Traditional Name: octyl-[4-(2-pyridylthio)butyl]amine Formula: C17H30N2S MolecularWeight: 294.4985

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNCCCCSC1=CC=CC=N1

Isomeric SMILES

CCCCCCCCNCCCCSC1=CC=CC=N1

InChI

InChI=1S/C17H30N2S/c1-2-3-4-5-6-8-13-18-14-10-11-16-20-17-12-7-9-15-19-17/h7,9,12,15,18H,2-6,8,10-11,13-14,16H2,1H3