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N-(3,4-dichlorophenyl)-2-({4-ethyl-5-[(2-methyl-1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
SpectraBase Compound ID CzsuVON8KMV
InChI InChI=1S/C22H21Cl2N5OS/c1-3-29-20(11-16-13(2)25-19-7-5-4-6-15(16)19)27-28-22(29)31-12-21(30)26-14-8-9-17(23)18(24)10-14/h4-10,25H,3,11-12H2,1-2H3,(H,26,30)
InChIKey WSPJQDXLUZMQJZ-UHFFFAOYSA-N
Mol Weight 474.41 g/mol
Molecular Formula C22H21Cl2N5OS
Exact Mass 473.084387 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9Ko9DZEqPBT
Name N-(3,4-dichlorophenyl)-2-({4-ethyl-5-[(2-methyl-1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 473.084386889 u
Formula C22H21Cl2N5OS
InChI InChI=1S/C22H21Cl2N5OS/c1-3-29-20(11-16-13(2)25-19-7-5-4-6-15(16)19)27-28-22(29)31-12-21(30)26-14-8-9-17(23)18(24)10-14/h4-10,25H,3,11-12H2,1-2H3,(H,26,30)
InChIKey WSPJQDXLUZMQJZ-UHFFFAOYSA-N
Molecular Weight 474.410 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5893
Solvent DMSO-d6
Source Vendor ID: NMR/12319413