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N-(2-{[4-tert-butyl-6-(trifluoromethyl)-2-pyrimidinyl]sulfanyl}ethyl)-4-chloro-1-methyl-1H-pyrazole-3-carboxamide
SpectraBase Compound ID Gb3KqU2o9AA
InChI InChI=1S/C16H19ClF3N5OS/c1-15(2,3)10-7-11(16(18,19)20)23-14(22-10)27-6-5-21-13(26)12-9(17)8-25(4)24-12/h7-8H,5-6H2,1-4H3,(H,21,26)
InChIKey RYPJLSDUJNGEGS-UHFFFAOYSA-N
Mol Weight 421.87 g/mol
Molecular Formula C16H19ClF3N5OS
Exact Mass 421.095094 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KvHh63u1bm6
Name N-(2-{[4-tert-butyl-6-(trifluoromethyl)-2-pyrimidinyl]sulfanyl}ethyl)-4-chloro-1-methyl-1H-pyrazole-3-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/C16H19ClF3N5OS/c1-15(2,3)10-7-11(16(18,19)20)23-14(22-10)27-6-5-21-13(26)12-9(17)8-25(4)24-12/h7-8H,5-6H2,1-4H3,(H,21,26)
InChIKey RYPJLSDUJNGEGS-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6523
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/1008709; UBI_ID: UBI-006525
Temperature 308 °C