N-(3-pyridin-4-ylsulfanylpropyl)dodecan-1-amine

Systemtic Name: N-(3-pyridin-4-ylsulfanylpropyl)dodecan-1-amine Openeye Name: N-[3-(4-pyridylsulfanyl)propyl]dodecan-1-amine CAS Name: N-[3-(pyridin-4-ylthio)propyl]-1-dodecanamine IUPAC Name: N-(3-pyridin-4-ylsulfanylpropyl)dodecan-1-amine Traditional Name: lauryl-[3-(4-pyridylthio)propyl]amine Formula: C20H36N2S MolecularWeight: 336.57824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNCCCSC1=CC=NC=C1

Isomeric SMILES

CCCCCCCCCCCCNCCCSC1=CC=NC=C1

InChI

InChI=1S/C20H36N2S/c1-2-3-4-5-6-7-8-9-10-11-15-21-16-12-19-23-20-13-17-22-18-14-20/h13-14,17-18,21H,2-12,15-16,19H2,1H3