SpectraBase Spectrum ID |
AqK6ry7Wv0i |
Name |
2-[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]-N-(3-chloro-4-fluorophenyl)acetamide |
Author |
A.V.Yarkov, IPAC, Russia |
Copyright |
Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
InChI |
InChI=1S/C20H15ClFN5OS/c21-16-8-14(6-7-17(16)22)26-18(28)11-29-20-15-9-25-27(19(15)23-12-24-20)10-13-4-2-1-3-5-13/h1-9,12H,10-11H2,(H,26,28) |
InChIKey |
MCTQVXGQMRKITL-UHFFFAOYSA-N |
NMR Offset |
15.3537 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_26204 |
Owner |
Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
Sample State |
soluted |
Solvent |
DMSO-d6 |
Source File Reference |
VendorID: D62508; Labnumber: UDSG-06730; SBI_ID: SBI-026208 |
Temperature |
308 °C |