SpectraBase Spectrum ID |
HShJldwct7u |
Name |
acetamide, 2-[[6-(acetylamino)-2-benzothiazolyl]thio]-N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
467.108581901 u |
Formula |
C22H21N5O3S2 |
InChI |
InChI=1S/C22H21N5O3S2/c1-13-20(21(30)27(26(13)3)16-7-5-4-6-8-16)25-19(29)12-31-22-24-17-10-9-15(23-14(2)28)11-18(17)32-22/h4-11H,12H2,1-3H3,(H,23,28)(H,25,29) |
InChIKey |
VBISYIRVCOCHJW-UHFFFAOYSA-N |
Molecular Weight |
467.562 g/mol |
NMR Offset |
16.1752 |
NMR Spectrometer Frequency |
200.133 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_62 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/7083738; Lab Info: LP; Lab Number: LP-0602743 |
Temperature |
39.85 °C |