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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-[2-(trifluoromethyl)phenyl]-

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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-[2-(trifluoromethyl)phenyl]-
SpectraBase Compound ID 1wir7HdB7oD
InChI InChI=1S/C25H22F3N7OS/c1-14-16(15(2)33-32-14)11-12-21-31-23-17-7-3-5-9-19(17)30-24(35(23)34-21)37-13-22(36)29-20-10-6-4-8-18(20)25(26,27)28/h3-10H,11-13H2,1-2H3,(H,29,36)(H,32,33)
InChIKey AOVGGWGADGFJDT-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 E5MXl0vL5Qc
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-[2-(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/c1-14-16(15(2)33-32-14)11-12-21-31-23-17-7-3-5-9-19(17)30-24(35(23)34-21)37-13-22(36)29-20-10-6-4-8-18(20)25(26,27)28/h3-10H,11-13H2,1-2H3,(H,29,36)(H,32,33)
InChIKey AOVGGWGADGFJDT-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_4238
Solvent DMSO-d6
Source Vendor ID: NMR/13279763