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N-(1,3-benzodioxol-5-yl)-2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID EH3xXweMk7E
InChI InChI=1S/C23H26N4O3S/c1-5-27-21(15-6-8-16(9-7-15)23(2,3)4)25-26-22(27)31-13-20(28)24-17-10-11-18-19(12-17)30-14-29-18/h6-12H,5,13-14H2,1-4H3,(H,24,28)
InChIKey BNTVSGCQULYGMH-UHFFFAOYSA-N
Mol Weight 438.55 g/mol
Molecular Formula C23H26N4O3S
Exact Mass 438.172562 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ES6SnsZmBiu
Name N-(1,3-benzodioxol-5-yl)-2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}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/C23H26N4O3S/c1-5-27-21(15-6-8-16(9-7-15)23(2,3)4)25-26-22(27)31-13-20(28)24-17-10-11-18-19(12-17)30-14-29-18/h6-12H,5,13-14H2,1-4H3,(H,24,28)
InChIKey BNTVSGCQULYGMH-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14330
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: D98206; Labnumber: GRES-17321; SBI_ID: SBI-014333
Temperature 308 °C