| SpectraBase Spectrum ID |
6jCr18bF17n |
| Name |
2-(2-{[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)-N,N-dimethylethanaminium chloride |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
504.105660726 u |
| Formula |
C23H25ClN4O3S2 |
| InChI |
InChI=1S/C23H24N4O3S2.ClH/c1-26(2)12-13-27-22(29)21-20(15-8-4-7-11-18(15)32-21)25-23(27)31-14-19(28)24-16-9-5-6-10-17(16)30-3;/h4-11H,12-14H2,1-3H3,(H,24,28);1H |
| InChIKey |
MIIAQDZFMXTTBU-UHFFFAOYSA-N |
| Molecular Weight |
505.051 g/mol |
| NMR Offset |
17.9978 |
| NMR Spectrometer Frequency |
500.136 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_9822 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13229885 |
![2-(2-{[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)-N,N-dimethylethanaminium chloride](/api/spectrum/6jCr18bF17n/structure.png?h=300&w=458 "2-(2-{[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl)-N,N-dimethylethanaminium chloride")
