SpectraBase Spectrum ID |
EB5Hwyr6d6o |
Name |
acetamide, 2-[[2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl]thio]-N-(3-methyl-1H-pyrazol-5-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 |
461.174627570 u |
Formula |
C22H23N9OS |
InChI |
InChI=1S/C22H23N9OS/c1-12-10-19(29-26-12)24-20(32)11-33-22-23-17-7-5-4-6-16(17)21-25-18(30-31(21)22)9-8-15-13(2)27-28-14(15)3/h4-7,10H,8-9,11H2,1-3H3,(H,27,28)(H2,24,26,29,32) |
InChIKey |
RRHYKTFVMRAHQV-UHFFFAOYSA-N |
Molecular Weight |
461.548 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_4239 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13279764 |