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methyl 4-(aminocarbonyl)-5-({[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-3-methyl-2-thiophenecarboxylate

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methyl 4-(aminocarbonyl)-5-({[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-3-methyl-2-thiophenecarboxylate
SpectraBase Compound ID Cv3eNFMUOUz
InChI InChI=1S/C17H17F3N4O4S/c1-7-12(14(21)26)15(29-13(7)16(27)28-2)22-11(25)6-24-9(8-3-4-8)5-10(23-24)17(18,19)20/h5,8H,3-4,6H2,1-2H3,(H2,21,26)(H,22,25)
InChIKey PBCUINCFWJLNRW-UHFFFAOYSA-N
Mol Weight 430.4 g/mol
Molecular Formula C17H17F3N4O4S
Exact Mass 430.092261 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G9ej6xm1Z0W
Name methyl 4-(aminocarbonyl)-5-({[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}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/C17H17F3N4O4S/c1-7-12(14(21)26)15(29-13(7)16(27)28-2)22-11(25)6-24-9(8-3-4-8)5-10(23-24)17(18,19)20/h5,8H,3-4,6H2,1-2H3,(H2,21,26)(H,22,25)
InChIKey PBCUINCFWJLNRW-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_18566
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/1031365; Labnumber: UBI5842; UZI_ID: UZI-018573
Temperature 308 °C