1H-pyridine-4-thione; N-(2-pyridin-4-ylsulfanylethyl)octan-1-amine

Systemtic Name: 1H-pyridine-4-thione; N-(2-pyridin-4-ylsulfanylethyl)octan-1-amine Openeye Name: 1H-pyridine-4-thione; N-[2-(4-pyridylsulfanyl)ethyl]octan-1-amine CAS Name: 1H-pyridine-4-thione; N-[2-(pyridin-4-ylthio)ethyl]-1-octanamine IUPAC Name: 1H-pyridine-4-thione; N-(2-pyridin-4-ylsulfanylethyl)octan-1-amine Traditional Name: octyl-[2-(4-pyridylthio)ethyl]amine; 1H-pyridine-4-thione Formula: C20H31N3S2 MolecularWeight: 377.61024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNCCSC1=CC=NC=C1.C1=CNC=CC1=S

Isomeric SMILES

CCCCCCCCNCCSC1=CC=NC=C1.C1=CNC=CC1=S

InChI

InChI=1S/C15H26N2S.C5H5NS/c1-2-3-4-5-6-7-10-16-13-14-18-15-8-11-17-12-9-15;7-5-1-3-6-4-2-5/h8-9,11-12,16H,2-7,10,13-14H2,1H3;1-4H,(H,6,7)