| SpectraBase Spectrum ID |
5U9rJfqeegQ |
| Name |
(6Z)-6-[3-bromo-4-(2-phenoxyethoxy)benzylidene]-5-imino-3-(methylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
515.992545768 u |
| Formula |
C21H17BrN4O3S2 |
| InChI |
InChI=1S/C21H17BrN4O3S2/c1-30-21-25-31-20-24-19(27)15(18(23)26(20)21)11-13-7-8-17(16(22)12-13)29-10-9-28-14-5-3-2-4-6-14/h2-8,11-12,23H,9-10H2,1H3/b15-11-,23-18? |
| InChIKey |
CYIQEMNWFNGYCX-PMOKRTJVSA-N |
| Molecular Weight |
517.416 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_185 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12259843 |
![(6Z)-6-[3-bromo-4-(2-phenoxyethoxy)benzylidene]-5-imino-3-(methylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one](/api/spectrum/5U9rJfqeegQ/structure.png?h=300&w=458 "(6Z)-6-[3-bromo-4-(2-phenoxyethoxy)benzylidene]-5-imino-3-(methylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one")
