Bookmark and Share
1 hit(s) found in 0.09 seconds
Search term: JFCWTELRCRWFFG-OQLLNIDSBQ
Found by InChIKey (full match)
Please login to be able to add spectra, identifiers, links and publications.
  • Comments
  • Image
  • Spectrum
  • CIF
  • Identifier
  • Description
  • Add:
Inherent Properties, Identifiers and References
ChemSpider ID: 4903544
Empirical Formula: C18H13I2NO2S2
Molecular Weight: 593.2403
Nominal Mass: 593 Da
Average Mass: 593.2403 Da
Monoisotopic Mass: 592.847689 Da
Systematic Name: (5E)-5-{[4-(benzyloxy)-3,5-diiodophenyl]methylidene}-3-methyl-2-t​hioxo-1,3-thiazolidin-4-one
SMILES: O=C1C(\SC(=S)N1C)=C/c3cc(I)c(OCc2ccccc2)c(I)c3 Copy
InChI: InChI=1/C18H13I2NO2S2/c1-21-17(22)15(25-18(21)24)9-12-7-13(19)16(​14(20)8-12)23-10-11-5-3-2-4-6-11/h2-9H,10H2,1H3/b15-9+ Copy
InChIKey: JFCWTELRCRWFFG-OQLLNIDSBQ
Std. InChI: InChI=1S/C18H13I2NO2S2/c1-21-17(22)15(25-18(21)24)9-12-7-13(19)16​(14(20)8-12)23-10-11-5-3-2-4-6-11/h2-9H,10H2,1H3/b15-9+ Copy
Std. InChIKey: JFCWTELRCRWFFG-OQLLNIDSSA-N
FilterAssociated Data Sources and Commercial Suppliers
Articles
Predicted Properties
SimBioSys LASSO