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isopropyl 2-({[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl}amino)-4-(4-fluorophenyl)-3-thiophenecarboxylate

View entire compound with spectra: 1 NMR

isopropyl 2-({[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl}amino)-4-(4-fluorophenyl)-3-thiophenecarboxylate
SpectraBase Compound ID Iuup1SJats7
InChI InChI=1S/C25H19ClF2N2O4S/c1-12(2)33-25(32)20-16(14-7-9-15(27)10-8-14)11-35-24(20)29-23(31)19-13(3)34-30-22(19)21-17(26)5-4-6-18(21)28/h4-12H,1-3H3,(H,29,31)
InChIKey LKQQFYASBKHYPI-UHFFFAOYSA-N
Mol Weight 516.95 g/mol
Molecular Formula C25H19ClF2N2O4S
Exact Mass 516.072212 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Afunt1XwQ4b
Name isopropyl 2-({[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl}amino)-4-(4-fluorophenyl)-3-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/C25H19ClF2N2O4S/c1-12(2)33-25(32)20-16(14-7-9-15(27)10-8-14)11-35-24(20)29-23(31)19-13(3)34-30-22(19)21-17(26)5-4-6-18(21)28/h4-12H,1-3H3,(H,29,31)
InChIKey LKQQFYASBKHYPI-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_15134
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/9124596; Labnumber: NSB-0095949; UZI_ID: UZI-015138
Temperature 313 °C