| SpectraBase Spectrum ID |
GLD8iGrrdkf |
| Name |
(6Z)-6-{4-[(2-fluorobenzyl)oxy]-3-methoxybenzylidene}-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 |
456.072610931 u |
| Formula |
C21H17FN4O3S2 |
| InChI |
InChI=1S/C21H17FN4O3S2/c1-28-17-10-12(7-8-16(17)29-11-13-5-3-4-6-15(13)22)9-14-18(23)26-20(24-19(14)27)31-25-21(26)30-2/h3-10,23H,11H2,1-2H3/b14-9-,23-18? |
| InChIKey |
ZKLUEUHCWVRRAB-GQFJHEMJSA-N |
| Molecular Weight |
456.510 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_149 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12259806 |
![(6Z)-6-{4-[(2-fluorobenzyl)oxy]-3-methoxybenzylidene}-5-imino-3-(methylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one](/api/spectrum/GLD8iGrrdkf/structure.png?h=300&w=458 "(6Z)-6-{4-[(2-fluorobenzyl)oxy]-3-methoxybenzylidene}-5-imino-3-(methylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one")
