| SpectraBase Spectrum ID |
D2TZ35yCCOu |
| Name |
2-[({3-[2-(1H-indol-3-yl)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)methyl]benzonitrile |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
492.107853627 u |
| Formula |
C28H20N4OS2 |
| InChI |
InChI=1S/C28H20N4OS2/c29-15-18-7-1-2-8-20(18)17-34-28-31-25-22-10-4-6-12-24(22)35-26(25)27(33)32(28)14-13-19-16-30-23-11-5-3-9-21(19)23/h1-12,16,30H,13-14,17H2 |
| InChIKey |
AZSTZQPOPXUGQA-UHFFFAOYSA-N |
| Molecular Weight |
492.615 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_7823 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13218575 |
![2-[({3-[2-(1H-indol-3-yl)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)methyl]benzonitrile](/api/spectrum/D2TZ35yCCOu/structure.png?h=300&w=458 "2-[({3-[2-(1H-indol-3-yl)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)methyl]benzonitrile")
