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2-methyl 4-propyl 5-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-3-methyl-2,4-thiophenedicarboxylate

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2-methyl 4-propyl 5-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-3-methyl-2,4-thiophenedicarboxylate
SpectraBase Compound ID Cu8e4XGSQUf
InChI InChI=1S/C25H22F2N4O5S/c1-4-10-36-24(33)18-13(2)19(25(34)35-3)37-23(18)30-22(32)15-12-28-31-17(20(26)27)11-16(29-21(15)31)14-8-6-5-7-9-14/h5-9,11-12,20H,4,10H2,1-3H3,(H,30,32)
InChIKey GEQJRLVDIROZHI-UHFFFAOYSA-N
Mol Weight 528.53 g/mol
Molecular Formula C25H22F2N4O5S
Exact Mass 528.127897 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2FDucJslOmp
Name 2-methyl 4-propyl 5-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-3-methyl-2,4-thiophenedicarboxylate
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/C25H22F2N4O5S/c1-4-10-36-24(33)18-13(2)19(25(34)35-3)37-23(18)30-22(32)15-12-28-31-17(20(26)27)11-16(29-21(15)31)14-8-6-5-7-9-14/h5-9,11-12,20H,4,10H2,1-3H3,(H,30,32)
InChIKey GEQJRLVDIROZHI-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_4580
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: 9683474; UBI_ID: UBI-004581
Temperature 353 °C