| SpectraBase Spectrum ID |
9I4moXquTv1 |
| Name |
1-{2-[3-(alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-3,5-xylyl)-2-thioureido]ethyl}-2-imidazolidinone |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
400.079251238 u |
| Formula |
C14H14F6N4OS |
| InChI |
InChI=1S/C14H14F6N4OS/c15-13(16,17)8-5-9(14(18,19)20)7-10(6-8)23-11(26)21-1-3-24-4-2-22-12(24)25/h5-7H,1-4H2,(H,22,25)(H2,21,23,26) |
| InChIKey |
ZPMMPPMTBUMGBH-UHFFFAOYSA-N |
| Molecular Weight |
400.343 g/mol |
| SMILES |
N(C=1C=C(C=C(C1)C(F)(F)F)C(F)(F)F)C(NCCN1CCNC1=O)=S |
![1-{2-[3-(alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-3,5-xylyl)-2-thioureido]ethyl}-2-imidazolidinone](/api/spectrum/9I4moXquTv1/structure.png?h=300&w=458 "1-{2-[3-(alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-3,5-xylyl)-2-thioureido]ethyl}-2-imidazolidinone")
