SpectraBase Spectrum ID |
HecKcvcCEuC |
Name |
[1,2,4]triazolo[1,5-c]quinazoline, 5-[[(4-chlorophenyl)methyl]thio]-2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
448.123693574 u |
Formula |
C23H21ClN6S |
InChI |
InChI=1S/C23H21ClN6S/c1-14-18(15(2)28-27-14)11-12-21-26-22-19-5-3-4-6-20(19)25-23(30(22)29-21)31-13-16-7-9-17(24)10-8-16/h3-10H,11-13H2,1-2H3,(H,27,28) |
InChIKey |
SETBCWUWGWFMNC-UHFFFAOYSA-N |
Molecular Weight |
448.976 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_4231 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13279756 |