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ethyl 4-cyano-5-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-3-methyl-2-thiophenecarboxylate
SpectraBase Compound ID Jyxx3Atp87Y
InChI InChI=1S/C23H17F2N5O3S/c1-3-33-23(32)18-12(2)14(10-26)22(34-18)29-21(31)15-11-27-30-17(19(24)25)9-16(28-20(15)30)13-7-5-4-6-8-13/h4-9,11,19H,3H2,1-2H3,(H,29,31)
InChIKey HEFYFHMLRSFQLG-UHFFFAOYSA-N
Mol Weight 481.48 g/mol
Molecular Formula C23H17F2N5O3S
Exact Mass 481.102017 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D3ZoG9AaB8I
Name ethyl 4-cyano-5-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-3-methyl-2-thiophenecarboxylate
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/C23H17F2N5O3S/c1-3-33-23(32)18-12(2)14(10-26)22(34-18)29-21(31)15-11-27-30-17(19(24)25)9-16(28-20(15)30)13-7-5-4-6-8-13/h4-9,11,19H,3H2,1-2H3,(H,29,31)
InChIKey HEFYFHMLRSFQLG-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2328
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: 9313140; UBI_ID: UBI-002329
Temperature 318 °C