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3-amino-6-(1,3-benzodioxol-5-yl)-N-(5-chloro-2-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
SpectraBase Compound ID JRmxDzzuGNk
InChI InChI=1S/C22H16ClN3O4S/c1-28-16-7-3-12(23)9-15(16)25-21(27)20-19(24)13-4-5-14(26-22(13)31-20)11-2-6-17-18(8-11)30-10-29-17/h2-9H,10,24H2,1H3,(H,25,27)
InChIKey UCNQXHNAIHMFGT-UHFFFAOYSA-N
Mol Weight 453.9 g/mol
Molecular Formula C22H16ClN3O4S
Exact Mass 453.055005 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4UTjDF5cQro
Name 3-amino-6-(1,3-benzodioxol-5-yl)-N-(5-chloro-2-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
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/C22H16ClN3O4S/c1-28-16-7-3-12(23)9-15(16)25-21(27)20-19(24)13-4-5-14(26-22(13)31-20)11-2-6-17-18(8-11)30-10-29-17/h2-9H,10,24H2,1H3,(H,25,27)
InChIKey UCNQXHNAIHMFGT-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22654
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: D60429; Labnumber: SHES3-0002; SBI_ID: SBI-022658
Temperature 318 °C