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3-chloro-N-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]-6-methyl-1-benzothiophene-2-carboxamide
SpectraBase Compound ID 2EOdnd1kylf
InChI InChI=1S/C21H18ClN3OS/c1-12-4-9-17-18(10-12)27-20(19(17)22)21(26)23-15-5-7-16(8-6-15)25-14(3)11-13(2)24-25/h4-11H,1-3H3,(H,23,26)
InChIKey VDZZAXKWHQUMBP-UHFFFAOYSA-N
Mol Weight 395.91 g/mol
Molecular Formula C21H18ClN3OS
Exact Mass 395.085911 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EHlecBX0Tbp
Name 3-chloro-N-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]-6-methyl-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/C21H18ClN3OS/c1-12-4-9-17-18(10-12)27-20(19(17)22)21(26)23-15-5-7-16(8-6-15)25-14(3)11-13(2)24-25/h4-11H,1-3H3,(H,23,26)
InChIKey VDZZAXKWHQUMBP-UHFFFAOYSA-N
NMR Offset 15.3209
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33891
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: 1998026; SBI_ID: SBI-033895
Temperature 297 °C