| SpectraBase Spectrum ID |
6HF6mAucmBz |
| Name |
ethyl 4-{5-[(Z)-(5-imino-3-(methylsulfanyl)-7-oxo-5H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-6(7H)-ylidene)methyl]-2-furyl}benzoate |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
440.061297355 u |
| Formula |
C20H16N4O4S2 |
| InChI |
InChI=1S/C20H16N4O4S2/c1-3-27-18(26)12-6-4-11(5-7-12)15-9-8-13(28-15)10-14-16(21)24-19(22-17(14)25)30-23-20(24)29-2/h4-10,21H,3H2,1-2H3/b14-10-,21-16? |
| InChIKey |
IPLBNCMLNFDBDF-OIQQPNLJSA-N |
| Molecular Weight |
440.492 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_131 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12259788 |
![ethyl 4-{5-[(Z)-(5-imino-3-(methylsulfanyl)-7-oxo-5H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-6(7H)-ylidene)methyl]-2-furyl}benzoate](/api/spectrum/6HF6mAucmBz/structure.png?h=300&w=458 "ethyl 4-{5-[(Z)-(5-imino-3-(methylsulfanyl)-7-oxo-5H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-6(7H)-ylidene)methyl]-2-furyl}benzoate")
