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methyl 2-({[3-amino-4-(4-chlorophenyl)-6-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]carbonyl}amino)-4,5-dimethyl-3-thiophenecarboxylate

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methyl 2-({[3-amino-4-(4-chlorophenyl)-6-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]carbonyl}amino)-4,5-dimethyl-3-thiophenecarboxylate
SpectraBase Compound ID JFEsY1987p8
InChI InChI=1S/C23H17ClF3N3O3S2/c1-9-10(2)34-20(15(9)22(32)33-3)30-19(31)18-17(28)16-13(11-4-6-12(24)7-5-11)8-14(23(25,26)27)29-21(16)35-18/h4-8H,28H2,1-3H3,(H,30,31)
InChIKey MUKSFWPUWBPXOX-UHFFFAOYSA-N
Mol Weight 539.98 g/mol
Molecular Formula C23H17ClF3N3O3S2
Exact Mass 539.035196 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Hv4Wv9koNnH
Name methyl 2-({[3-amino-4-(4-chlorophenyl)-6-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]carbonyl}amino)-4,5-dimethyl-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/C23H17ClF3N3O3S2/c1-9-10(2)34-20(15(9)22(32)33-3)30-19(31)18-17(28)16-13(11-4-6-12(24)7-5-11)8-14(23(25,26)27)29-21(16)35-18/h4-8H,28H2,1-3H3,(H,30,31)
InChIKey MUKSFWPUWBPXOX-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_12
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/9152817; Labnumber: 00368; UZI_ID: UZI-000013
Temperature 308 °C