| SpectraBase Spectrum ID |
CEf1immdDiP |
| Name |
2-{[(3-cyclohexyl-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 |
431.112604655 u |
| Formula |
C24H21N3OS2 |
| InChI |
InChI=1S/C24H21N3OS2/c25-14-16-8-4-5-9-17(16)15-29-24-26-21-19-12-6-7-13-20(19)30-22(21)23(28)27(24)18-10-2-1-3-11-18/h4-9,12-13,18H,1-3,10-11,15H2 |
| InChIKey |
AOONJPJYDWQTTE-UHFFFAOYSA-N |
| Molecular Weight |
431.572 g/mol |
| NMR Offset |
17.9979 |
| NMR Spectrometer Frequency |
500.136 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_9852 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13229925 |
![2-{[(3-cyclohexyl-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl)sulfanyl]methyl}benzonitrile](/api/spectrum/CEf1immdDiP/structure.png?h=300&w=458 "2-{[(3-cyclohexyl-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl)sulfanyl]methyl}benzonitrile")
