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N-(3,4-dichlorophenyl)-2-({4-(2-furylmethyl)-5-[(2-methyl-1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
SpectraBase Compound ID 6X4jTorD4Mw
InChI InChI=1S/C25H21Cl2N5O2S/c1-15-19(18-6-2-3-7-22(18)28-15)12-23-30-31-25(32(23)13-17-5-4-10-34-17)35-14-24(33)29-16-8-9-20(26)21(27)11-16/h2-11,28H,12-14H2,1H3,(H,29,33)
InChIKey RGAUUEKSORFSJA-UHFFFAOYSA-N
Mol Weight 526.44 g/mol
Molecular Formula C25H21Cl2N5O2S
Exact Mass 525.079302 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6m4LWmD5Vtk
Name N-(3,4-dichlorophenyl)-2-({4-(2-furylmethyl)-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 525.079301508 u
Formula C25H21Cl2N5O2S
InChI InChI=1S/C25H21Cl2N5O2S/c1-15-19(18-6-2-3-7-22(18)28-15)12-23-30-31-25(32(23)13-17-5-4-10-34-17)35-14-24(33)29-16-8-9-20(26)21(27)11-16/h2-11,28H,12-14H2,1H3,(H,29,33)
InChIKey RGAUUEKSORFSJA-UHFFFAOYSA-N
Molecular Weight 526.442 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5891
Solvent DMSO-d6
Source Vendor ID: NMR/12319411