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3-chloro-N-[1-(4-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-1-benzothiophene-2-carboxamide

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3-chloro-N-[1-(4-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-1-benzothiophene-2-carboxamide
SpectraBase Compound ID EUlw4DWHaFO
InChI InChI=1S/C21H17Cl2N3OS/c1-12-19(13(2)26(25-12)11-14-7-9-15(22)10-8-14)24-21(27)20-18(23)16-5-3-4-6-17(16)28-20/h3-10H,11H2,1-2H3,(H,24,27)
InChIKey GSINWQLWWQRCGJ-UHFFFAOYSA-N
Mol Weight 430.35 g/mol
Molecular Formula C21H17Cl2N3OS
Exact Mass 429.046939 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KEi2iwqbYsQ
Name 3-chloro-N-[1-(4-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-1-benzothiophene-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/C21H17Cl2N3OS/c1-12-19(13(2)26(25-12)11-14-7-9-15(22)10-8-14)24-21(27)20-18(23)16-5-3-4-6-17(16)28-20/h3-10H,11H2,1-2H3,(H,24,27)
InChIKey GSINWQLWWQRCGJ-UHFFFAOYSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1738
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: 9031217; UBI_ID: UBI-001739
Temperature 308 °C