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5-(5-chloro-2-thienyl)-N-[3,5-dimethyl-1-(2-methylbenzyl)-1H-pyrazol-4-yl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

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5-(5-chloro-2-thienyl)-N-[3,5-dimethyl-1-(2-methylbenzyl)-1H-pyrazol-4-yl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID EElBuh9oAx5
InChI InChI=1S/C25H20ClF3N6OS/c1-13-6-4-5-7-16(13)12-34-15(3)23(14(2)32-34)31-24(36)18-11-22-30-17(19-8-9-21(26)37-19)10-20(25(27,28)29)35(22)33-18/h4-11H,12H2,1-3H3,(H,31,36)
InChIKey SSIHKNJWRQXYBY-UHFFFAOYSA-N
Mol Weight 544.98 g/mol
Molecular Formula C25H20ClF3N6OS
Exact Mass 544.105993 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Gj8uPi7KKyj
Name 5-(5-chloro-2-thienyl)-N-[3,5-dimethyl-1-(2-methylbenzyl)-1H-pyrazol-4-yl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
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/C25H20ClF3N6OS/c1-13-6-4-5-7-16(13)12-34-15(3)23(14(2)32-34)31-24(36)18-11-22-30-17(19-8-9-21(26)37-19)10-20(25(27,28)29)35(22)33-18/h4-11H,12H2,1-3H3,(H,31,36)
InChIKey SSIHKNJWRQXYBY-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_6312
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/1025340; Labnumber: COL1316; UZI_ID: UZI-006314
Temperature 318 °C