2-[4-(Butylsulfanyl)-2,5-dimethoxyphenyl]ethanamine

ChemSpider ID: 21106235
Molecular Formula: C₁₄H₂₃NO₂S
Average mass: 269.403015 Da
Monoisotopic mass: 269.144989 Da
Systematic name

2-[4-(Butylsulfanyl)-2,5-dimethoxyphenyl]ethanamine
SMILES and InChIs

SMILES:

COc1cc(SCCCC)c(cc1CCN)OC Copied

Std. InChI:

InChI=1S/C14H23NO2S/c1-4-5-8-18-14-10-12(16-2)11(6-7-15)9-13(14)17-3/h9-10H,4-8,15H2,1-3H3 Copied

Std. InChIKey:

LGUVDOBGXUFUAJ-UHFFFAOYSA-N Copied
Cite this record
CSID:21106235, http://www.chemspider.com/Chemical-Structure.21106235.html (accessed 02:44, Jul 23, 2014) Copied

Names and Identifiers

Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

Patents	Personal Collections
Publication or Magazine Article	Web-based Article (blog or commentary)
Available Chemicals Databases	Biological Properties
Chemical Reactions	Chemical Safety Data
Drugs or Compounds in Development	Imaging Agents
Information Aggregators	Journal Publishers via MeSH
Ligand/binding/crystal Structure Databases	Metabolic Pathways
Molecular Libraries Screening Center Network	Natural Products
NIH Substance Repository	Physical Properties (including SAR/QSAR databases)
Protein 3D Structures	Spectroscopy Databases
Substance Vendors	Theoretical Properties
Toxicology/Environmental Databases	Virtual Library