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2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(6-ethyl-2-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide

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2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(6-ethyl-2-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
SpectraBase Compound ID ExLcJ26dPZV
InChI InChI=1S/C16H15BrF3N5O2S/c1-4-9-5-10-14(28-9)21-8(3)25(15(10)27)22-11(26)6-24-7(2)12(17)13(23-24)16(18,19)20/h5H,4,6H2,1-3H3,(H,22,26)
InChIKey RCEUWHXPMSTSRY-UHFFFAOYSA-N
Mol Weight 478.29 g/mol
Molecular Formula C16H15BrF3N5O2S
Exact Mass 477.008193 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9exZTwg9ew6
Name 2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(6-ethyl-2-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
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/C16H15BrF3N5O2S/c1-4-9-5-10-14(28-9)21-8(3)25(15(10)27)22-11(26)6-24-7(2)12(17)13(23-24)16(18,19)20/h5H,4,6H2,1-3H3,(H,22,26)
InChIKey RCEUWHXPMSTSRY-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_1089
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/1249522; Labnumber: AC-NHALL/0696124; UZI_ID: UZI-001091
Temperature 318 °C