| SpectraBase Spectrum ID |
Cu0YJzlRPCw |
| Name |
2-({[3-(3-isopropoxypropyl)-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 |
449.123169339 u |
| Formula |
C24H23N3O2S2 |
| InChI |
InChI=1S/C24H23N3O2S2/c1-16(2)29-13-7-12-27-23(28)22-21(19-10-5-6-11-20(19)31-22)26-24(27)30-15-18-9-4-3-8-17(18)14-25/h3-6,8-11,16H,7,12-13,15H2,1-2H3 |
| InChIKey |
CEFDZCQUQAMLPU-UHFFFAOYSA-N |
| Molecular Weight |
449.587 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_6260 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12328361 |
![2-({[3-(3-isopropoxypropyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}methyl)benzonitrile](/api/spectrum/Cu0YJzlRPCw/structure.png?h=300&w=458 "2-({[3-(3-isopropoxypropyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}methyl)benzonitrile")
