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N-[3-(aminocarbonyl)-5,6-dihydro-4H-cyclopenta[b]thien-2-yl]-7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide

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N-[3-(aminocarbonyl)-5,6-dihydro-4H-cyclopenta[b]thien-2-yl]-7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SpectraBase Compound ID 90GQGDIY8Ad
InChI InChI=1S/C22H17F2N5O2S/c23-18(24)15-9-14(11-5-2-1-3-6-11)27-20-13(10-26-29(15)20)21(31)28-22-17(19(25)30)12-7-4-8-16(12)32-22/h1-3,5-6,9-10,18H,4,7-8H2,(H2,25,30)(H,28,31)
InChIKey ZLRJHNDUACHOPY-UHFFFAOYSA-N
Mol Weight 453.47 g/mol
Molecular Formula C22H17F2N5O2S
Exact Mass 453.107102 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID aE4XAIjnpj
Name N-[3-(aminocarbonyl)-5,6-dihydro-4H-cyclopenta[b]thien-2-yl]-7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidine-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/C22H17F2N5O2S/c23-18(24)15-9-14(11-5-2-1-3-6-11)27-20-13(10-26-29(15)20)21(31)28-22-17(19(25)30)12-7-4-8-16(12)32-22/h1-3,5-6,9-10,18H,4,7-8H2,(H2,25,30)(H,28,31)
InChIKey ZLRJHNDUACHOPY-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2326
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: 9312413; UBI_ID: UBI-002327
Temperature 318 °C