| SpectraBase Spectrum ID |
AfoRcsjbwoc |
| Name |
Ethyl 4-{4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}-1-piperazinecarboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
481.089676309 u |
| Formula |
C21H24ClN3O4S2 |
| InChI |
InChI=1S/C21H24ClN3O4S2/c1-2-29-20(28)24-12-10-23(11-13-24)18(26)8-5-9-25-19(27)17(31-21(25)30)14-15-6-3-4-7-16(15)22/h3-4,6-7,14H,2,5,8-13H2,1H3/b17-14- |
| InChIKey |
FOUGYKYLEBSCJK-VKAVYKQESA-N |
| Molecular Weight |
482.013 g/mol |
| SMILES |
C1=CC=C(\C=C\2C(N(C(S2)=S)CCCC(N2CCN(CC2)C(=O)OCC)=O)=O)C(Cl)=C1 |
![ethyl 4-{4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}-1-piperazinecarboxylate](/api/spectrum/AfoRcsjbwoc/structure.png?h=300&w=458 "ethyl 4-{4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}-1-piperazinecarboxylate")
