SpectraBase Spectrum ID |
36w71tVxgV3 |
Name |
2-Chloro-4-[(Z)-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methoxybenzoate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
404.989627914 u |
Formula |
C18H12ClNO4S2 |
InChI |
InChI=1S/C18H12ClNO4S2/c1-23-12-5-3-11(4-6-12)17(22)24-14-7-2-10(8-13(14)19)9-15-16(21)20-18(25)26-15/h2-9H,1H3,(H,20,21,25)/b15-9- |
InChIKey |
XTGMAIGBOYYJGM-DHDCSXOGSA-N |
Molecular Weight |
405.870 g/mol |
SMILES |
N1C(\C(SC1=S)=C\C=1C=C(Cl)C(OC(C2=CC=C(C=C2)OC)=O)=CC1)=O |