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methyl 2-({[5-(5-ethyl-2-thienyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-5-methyl-3-thiophenecarboxylate
SpectraBase Compound ID IQQwDmavuFL
InChI InChI=1S/C21H17F3N4O3S2/c1-4-11-5-6-15(33-11)13-8-16(21(22,23)24)28-17(25-13)9-14(27-28)18(29)26-19-12(20(30)31-3)7-10(2)32-19/h5-9H,4H2,1-3H3,(H,26,29)
InChIKey IJSWTNZUAROXDJ-UHFFFAOYSA-N
Mol Weight 494.51 g/mol
Molecular Formula C21H17F3N4O3S2
Exact Mass 494.069417 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JUWos2jK73H
Name methyl 2-({[5-(5-ethyl-2-thienyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-5-methyl-3-thiophenecarboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H17F3N4O3S2/c1-4-11-5-6-15(33-11)13-8-16(21(22,23)24)28-17(25-13)9-14(27-28)18(29)26-19-12(20(30)31-3)7-10(2)32-19/h5-9H,4H2,1-3H3,(H,26,29)
InChIKey IJSWTNZUAROXDJ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_6016
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/1023789; Labnumber: COL0111; UZI_ID: UZI-006018
Temperature 318 °C