SpectraBase Spectrum ID |
EO8dIFolDES |
Name |
5-(2,4-Dichlorobenzylidene)-3-phenyl-2-(phenylimino)-4-thiazolidinone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
424.020389652 u |
Formula |
C22H14Cl2N2OS |
InChI |
InChI=1S/C22H14Cl2N2OS/c23-16-12-11-15(19(24)14-16)13-20-21(27)26(18-9-5-2-6-10-18)22(28-20)25-17-7-3-1-4-8-17/h1-14H/b20-13-,25-22- |
InChIKey |
QZFGQBJWAPWRSN-ORVWWNJKSA-N |
Molecular Weight |
425.333 g/mol |
SMILES |
C1(\C(S\C(N1c1ccccc1)=N\c1ccccc1)=C\c1c(cc(cc1)Cl)Cl)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946824 |