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3-bromo-5-(4-bromophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

View entire compound with spectra: 1 NMR

3-bromo-5-(4-bromophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SpectraBase Compound ID C8AiiyIJmLW
InChI InChI=1S/C23H14Br2F3N5OS/c24-12-7-5-11(6-8-12)15-9-17(23(26,27)28)33-20(30-15)18(25)19(32-33)21(34)31-22-14(10-29)13-3-1-2-4-16(13)35-22/h5-9H,1-4H2,(H,31,34)
InChIKey XKIIUYJDNZGDBB-UHFFFAOYSA-N
Mol Weight 625.26 g/mol
Molecular Formula C23H14Br2F3N5OS
Exact Mass 622.923792 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5hal1M6g3IX
Name 3-bromo-5-(4-bromophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-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/C23H14Br2F3N5OS/c24-12-7-5-11(6-8-12)15-9-17(23(26,27)28)33-20(30-15)18(25)19(32-33)21(34)31-22-14(10-29)13-3-1-2-4-16(13)35-22/h5-9H,1-4H2,(H,31,34)
InChIKey XKIIUYJDNZGDBB-UHFFFAOYSA-N
NMR Offset 16.5281
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2296
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/8050105; UBI_ID: UBI-002297
Temperature 308 °C