| SpectraBase Spectrum ID |
KfCMW9ig7Dk |
| Name |
5H-Thiazolo[3,2-A]pyrimidine-6-carboxylic acid, 5-oxo-2,3-dihydro-, (2,3-dichlorophenyl)amide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
340.979253114 u |
| Formula |
C13H9Cl2N3O2S |
| InChI |
InChI=1S/C13H9Cl2N3O2S/c14-8-2-1-3-9(10(8)15)17-11(19)7-6-16-13-18(12(7)20)4-5-21-13/h1-3,6H,4-5H2,(H,17,19) |
| InChIKey |
XLEFTKODRORTLM-UHFFFAOYSA-N |
| Molecular Weight |
342.200 g/mol |
| SMILES |
C1=CC=C(C(=C1Cl)Cl)NC(C=1C(N2C(=NC1)SCC2)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948856 |
![5H-Thiazolo[3,2-a]pyrimidine-6-carboxylic acid, 5-oxo-2,3-dihydro-, (2,3-dichlorophenyl)amide](/api/spectrum/KfCMW9ig7Dk/structure.png?h=300&w=458 "5H-Thiazolo[3,2-a]pyrimidine-6-carboxylic acid, 5-oxo-2,3-dihydro-, (2,3-dichlorophenyl)amide")
