| SpectraBase Spectrum ID |
3pOnQpvHZQa |
| Name |
Ethyl {[(5E)-5-(4-chlorobenzylidene)-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]sulfanyl}acetate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
340.994713295 u |
| Formula |
C14H12ClNO3S2 |
| InChI |
InChI=1S/C14H12ClNO3S2/c1-2-19-12(17)8-20-14-16-13(18)11(21-14)7-9-3-5-10(15)6-4-9/h3-7H,2,8H2,1H3/b11-7+ |
| InChIKey |
ZAKMNXNKYSLRSY-YRNVUSSQSA-N |
| Molecular Weight |
341.827 g/mol |
| SMILES |
CCOC(CSC1=NC(\C(=C/C=2C=CC(=CC2)Cl)S1)=O)=O |