| SpectraBase Spectrum ID |
HQ7xyOpwqWL |
| Name |
7-methyl-6-{[7-methyl-5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl](thiophen-2-yl)methyl}-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-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 |
516.070816666 u |
| Formula |
C21H20N6O4S3 |
| InChI |
InChI=1S/C21H20N6O4S3/c1-8(2)16-24-26-18(30)12(14(28)22-20(26)33-16)11(10-6-5-7-32-10)13-15(29)23-21-27(19(13)31)25-17(34-21)9(3)4/h5-9,11,28-29H,1-4H3 |
| InChIKey |
SLTRVOHELKIIDW-UHFFFAOYSA-N |
| Molecular Weight |
516.609 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_1167 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/7116212; Lab Info: CEP; Lab Number: CEP-1980721 |
| Temperature |
29.85 °C |
![7-methyl-6-{[7-methyl-5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl](thiophen-2-yl)methyl}-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one](/api/spectrum/HQ7xyOpwqWL/structure.png?h=300&w=458 "7-methyl-6-{[7-methyl-5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl](thiophen-2-yl)methyl}-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one")
