| SpectraBase Spectrum ID |
Cw7Bqeaf7Ju |
| Name |
5-[2'-(2'', 5''-Dichlorophenyl)-2'-oxoethyl]-3-benzyl-2-thioxo-4-oxo-1,3-thiazolidine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
408.976476409 u |
| Formula |
C18H13Cl2NO2S2 |
| InChI |
InChI=1S/C18H13Cl2NO2S2/c19-12-6-7-14(20)13(8-12)15(22)9-16-17(23)21(18(24)25-16)10-11-4-2-1-3-5-11/h1-8,16H,9-10H2 |
| InChIKey |
ZGGYIUXJOCUHRJ-UHFFFAOYSA-N |
| Molecular Weight |
410.333 g/mol |
| SMILES |
C1(N(C(C(S1)CC(C=1C(=CC=C(C1)Cl)Cl)=O)=O)CC=1C=CC=CC1)=S |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.806136 |
![5-[2'-(2", 5"-Dichlorophenyl)-2'-oxoethyl]-3-benzyl-2-thioxo-4-oxo-1,3-thiazolidine](/api/spectrum/Cw7Bqeaf7Ju/structure.png?h=300&w=458 "5-[2'-(2\", 5\"-Dichlorophenyl)-2'-oxoethyl]-3-benzyl-2-thioxo-4-oxo-1,3-thiazolidine")
