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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-(trifluoromethyl)phenyl]-

View entire compound with spectra: 1 NMR

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-(trifluoromethyl)phenyl]-
SpectraBase Compound ID AVB6EqCpm77
InChI InChI=1S/C25H22F3N7OS/c1-14-18(15(2)33-32-14)10-11-21-31-23-19-8-3-4-9-20(19)30-24(35(23)34-21)37-13-22(36)29-17-7-5-6-16(12-17)25(26,27)28/h3-9,12H,10-11,13H2,1-2H3,(H,29,36)(H,32,33)
InChIKey IKJQADNLMOHPKH-UHFFFAOYSA-N
Mol Weight 525.55 g/mol
Molecular Formula C25H22F3N7OS
Exact Mass 525.155864 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 79M7975BgjJ
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-(trifluoromethyl)phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 525.155864018 u
Formula C25H22F3N7OS
InChI InChI=1S/C25H22F3N7OS/c1-14-18(15(2)33-32-14)10-11-21-31-23-19-8-3-4-9-20(19)30-24(35(23)34-21)37-13-22(36)29-17-7-5-6-16(12-17)25(26,27)28/h3-9,12H,10-11,13H2,1-2H3,(H,29,36)(H,32,33)
InChIKey IKJQADNLMOHPKH-UHFFFAOYSA-N
Molecular Weight 525.554 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4234
Solvent DMSO-d6
Source Vendor ID: NMR/13279759