| SpectraBase Spectrum ID |
SMo66iiDJS |
| Name |
2-({[3-(3-methoxypropyl)-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 |
421.091869210 u |
| Formula |
C22H19N3O2S2 |
| InChI |
InChI=1S/C22H19N3O2S2/c1-27-12-6-11-25-21(26)20-19(17-9-4-5-10-18(17)29-20)24-22(25)28-14-16-8-3-2-7-15(16)13-23/h2-5,7-10H,6,11-12,14H2,1H3 |
| InChIKey |
IUANUINOCUUSAQ-UHFFFAOYSA-N |
| Molecular Weight |
421.533 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_7103 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12329637 |
![2-({[3-(3-methoxypropyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}methyl)benzonitrile](/api/spectrum/SMo66iiDJS/structure.png?h=300&w=458 "2-({[3-(3-methoxypropyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}methyl)benzonitrile")
