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2-{[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide

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2-{[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide
SpectraBase Compound ID EcYWNba5woz
InChI InChI=1S/C26H25ClN4O4S/c1-4-35-20-11-9-19(10-12-20)31-25(17-5-7-18(27)8-6-17)29-30-26(31)36-16-24(32)28-22-14-13-21(33-2)15-23(22)34-3/h5-15H,4,16H2,1-3H3,(H,28,32)
InChIKey CWVYYUYYUIUPDB-UHFFFAOYSA-N
Mol Weight 525.02 g/mol
Molecular Formula C26H25ClN4O4S
Exact Mass 524.128504 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4oa7gH6rM9h
Name 2-{[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide
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/C26H25ClN4O4S/c1-4-35-20-11-9-19(10-12-20)31-25(17-5-7-18(27)8-6-17)29-30-26(31)36-16-24(32)28-22-14-13-21(33-2)15-23(22)34-3/h5-15H,4,16H2,1-3H3,(H,28,32)
InChIKey CWVYYUYYUIUPDB-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4051
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: D98477; Labnumber: GRES-21508; SBI_ID: SBI-004053
Temperature 308 °C