Want to comment
on this record?

2,2'-Disulfanediylbis[5-acetyl-4-(4-chlorophenyl)-6-methylnicotinonitrile]

ChemSpider ID: 337210
Molecular Formula: C₃₀H₂₀Cl₂N₄O₂S₂
Average mass: 603.541382 Da
Monoisotopic mass: 602.040466 Da
Systematic name

2,2'-Disulfanediylbis[5-acetyl-4-(4-chlorophenyl)-6-methylnicotinonitrile]
SMILES and InChIs

SMILES:

Clc1ccc(cc1)c4c(C#N)c(SSc2nc(c(c(c2C#N)c3ccc(Cl)cc3)C(=O)C)C)nc(c4C(=O)C)C Copied

Std. InChI:

InChI=1S/C30H20Cl2N4O2S2/c1-15-25(17(3)37)27(19-5-9-21(31)10-6-19)23(13-33)29(35-15)39-40-30-24(14-34)28(20-7-11-22(32)12-8-20)26(18(4)38)16(2)36-30/h5-12H,1-4H3 Copied

Std. InChIKey:

NRGXHZADCWXWJI-UHFFFAOYSA-N Copied
Cite this record
CSID:337210, http://www.chemspider.com/Chemical-Structure.337210.html (accessed 21:51, May 20, 2013) Copied

Validated by Experts, Validated by Users, Non-Validated, Removed by Users, Redirected by Users, Redirect Approved by Experts

AIDS144091 [DBID]

AIDS-144091 [DBID]

NCI60_022961 [DBID]

NSC666142 [DBID]

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

Click to predict properties on the Chemicalize site

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

Advertise Sponsor