SpectraBase Spectrum ID |
GE39l7w6PuS |
Name |
methyl 4-({[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]acetyl}amino)benzoate |
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/C22H19N5O3S/c1-30-22(29)16-7-9-17(10-8-16)26-19(28)13-31-21-18-11-25-27(20(18)23-14-24-21)12-15-5-3-2-4-6-15/h2-11,14H,12-13H2,1H3,(H,26,28) |
InChIKey |
GKWFZDFNMYBYOL-UHFFFAOYSA-N |
NMR Offset |
15.328 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_10050 |
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: D62474; Labnumber: UDSG-06680; SBI_ID: SBI-010053 |
Temperature |
318 °C |