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2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)acetamide
SpectraBase Compound ID 2n8QZYGhxQa
InChI InChI=1S/C21H24N4O3S/c1-5-25-20(15-7-9-16(27-3)10-8-15)23-24-21(25)29-13-19(26)22-17-12-14(2)6-11-18(17)28-4/h6-12H,5,13H2,1-4H3,(H,22,26)
InChIKey ZDXFLCWTHUZVQG-UHFFFAOYSA-N
Mol Weight 412.51 g/mol
Molecular Formula C21H24N4O3S
Exact Mass 412.156912 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2mLSBrOfB4S
Name 2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)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/C21H24N4O3S/c1-5-25-20(15-7-9-16(27-3)10-8-15)23-24-21(25)29-13-19(26)22-17-12-14(2)6-11-18(17)28-4/h6-12H,5,13H2,1-4H3,(H,22,26)
InChIKey ZDXFLCWTHUZVQG-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14575
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: D98716; Labnumber: GRES-25373; SBI_ID: SBI-014578
Temperature 318 °C