| SpectraBase Spectrum ID |
KStKr7MWQbg |
| Name |
Benzamide, N-(5-carbamoylmethyl-3-ethyl-4-oxo-2-thioxoimidazolidin-1-yl)-4-chloro- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
354.055339230 u |
| Formula |
C14H15ClN4O3S |
| InChI |
InChI=1S/C14H15ClN4O3S/c1-2-18-13(22)10(7-11(16)20)19(14(18)23)17-12(21)8-3-5-9(15)6-4-8/h3-6,10H,2,7H2,1H3,(H2,16,20)(H,17,21) |
| InChIKey |
RYYGIWGBOAWOLZ-UHFFFAOYSA-N |
| Molecular Weight |
354.812 g/mol |
| SMILES |
CCN1C(N(C(C1=O)CC(=O)N)NC(C=1C=CC(=CC1)Cl)=O)=S |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.898111 |
