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3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)propanamide

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3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)propanamide
SpectraBase Compound ID 4XY76mY94b7
InChI InChI=1S/C18H17BrF3N5O2S/c1-8-7-11-16(30-8)23-9(2)27(17(11)29)24-12(28)5-6-26-14(10-3-4-10)13(19)15(25-26)18(20,21)22/h7,10H,3-6H2,1-2H3,(H,24,28)
InChIKey QZVJCANFPXPMHL-UHFFFAOYSA-N
Mol Weight 504.33 g/mol
Molecular Formula C18H17BrF3N5O2S
Exact Mass 503.023843 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Kq0TZ23b5OV
Name 3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)propanamide
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/C18H17BrF3N5O2S/c1-8-7-11-16(30-8)23-9(2)27(17(11)29)24-12(28)5-6-26-14(10-3-4-10)13(19)15(25-26)18(20,21)22/h7,10H,3-6H2,1-2H3,(H,24,28)
InChIKey QZVJCANFPXPMHL-UHFFFAOYSA-N
NMR Offset 15.3538
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_1073
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/1192870; Labnumber: AC-NHALL/0695033; UZI_ID: UZI-001075
Temperature 308 °C