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2-({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)-N-(3-methoxyphenyl)acetamide
SpectraBase Compound ID 1Ztxd7cTg1p
InChI InChI=1S/C25H25N7O2S/c1-16-13-17(2)31(29-16)12-11-22-28-24-20-9-4-5-10-21(20)27-25(32(24)30-22)35-15-23(33)26-18-7-6-8-19(14-18)34-3/h4-10,13-14H,11-12,15H2,1-3H3,(H,26,33)
InChIKey ZYGIMJSAAQKCFC-UHFFFAOYSA-N
Mol Weight 487.58 g/mol
Molecular Formula C25H25N7O2S
Exact Mass 487.179044 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LNlLqdNjbSI
Name 2-({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)-N-(3-methoxyphenyl)acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 487.179044245 u
Formula C25H25N7O2S
InChI InChI=1S/C25H25N7O2S/c1-16-13-17(2)31(29-16)12-11-22-28-24-20-9-4-5-10-21(20)27-25(32(24)30-22)35-15-23(33)26-18-7-6-8-19(14-18)34-3/h4-10,13-14H,11-12,15H2,1-3H3,(H,26,33)
InChIKey ZYGIMJSAAQKCFC-UHFFFAOYSA-N
Molecular Weight 487.582 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_8498
Solvent DMSO-d6
Source Vendor ID: NMR/13219724