SpectraBase Spectrum ID |
G0a6pcfzZ2Z |
Name |
Ethyl 4-({4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
488.063127208 u |
Formula |
C23H21ClN2O4S2 |
InChI |
InChI=1S/C23H21ClN2O4S2/c1-2-30-22(29)15-9-11-17(12-10-15)25-20(27)8-5-13-26-21(28)19(32-23(26)31)14-16-6-3-4-7-18(16)24/h3-4,6-7,9-12,14H,2,5,8,13H2,1H3,(H,25,27)/b19-14- |
InChIKey |
PKLBPUWUEYXPAL-RGEXLXHISA-N |
Molecular Weight |
489.004 g/mol |
SMILES |
N(C(CCCN1C(S\C(C1=O)=C\C=1C(Cl)=CC=CC1)=S)=O)C=1C=CC(C(=O)OCC)=CC1 |