| SpectraBase Spectrum ID |
KfXlVTgfXVQ |
| Name |
(6Z)-5-imino-6-{4-[(3-methylbenzyl)oxy]benzylidene}-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 |
422.087118182 u |
| Formula |
C21H18N4O2S2 |
| InChI |
InChI=1S/C21H18N4O2S2/c1-13-4-3-5-15(10-13)12-27-16-8-6-14(7-9-16)11-17-18(22)25-20(23-19(17)26)29-24-21(25)28-2/h3-11,22H,12H2,1-2H3/b17-11-,22-18? |
| InChIKey |
LIMPQKCQYHMPDX-JMCWYTMQSA-N |
| Molecular Weight |
422.521 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_158 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12259815 |
![(6Z)-5-imino-6-{4-[(3-methylbenzyl)oxy]benzylidene}-3-(methylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one](/api/spectrum/KfXlVTgfXVQ/structure.png?h=300&w=458 "(6Z)-5-imino-6-{4-[(3-methylbenzyl)oxy]benzylidene}-3-(methylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one")
