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2-{[5-(2-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)acetamide
SpectraBase Compound ID ASgSLCpP9yn
InChI InChI=1S/C26H25ClN4O3S/c1-4-34-19-12-10-18(11-13-19)31-25(20-7-5-6-8-21(20)27)29-30-26(31)35-16-24(32)28-22-15-17(2)9-14-23(22)33-3/h5-15H,4,16H2,1-3H3,(H,28,32)
InChIKey NNRUCSUDAVIXDF-UHFFFAOYSA-N
Mol Weight 509.02 g/mol
Molecular Formula C26H25ClN4O3S
Exact Mass 508.13359 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EowRutAMyzl
Name 2-{[5-(2-chlorophenyl)-4-(4-ethoxyphenyl)-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/C26H25ClN4O3S/c1-4-34-19-12-10-18(11-13-19)31-25(20-7-5-6-8-21(20)27)29-30-26(31)35-16-24(32)28-22-15-17(2)9-14-23(22)33-3/h5-15H,4,16H2,1-3H3,(H,28,32)
InChIKey NNRUCSUDAVIXDF-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11710
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: E08634; Labnumber: GRES-37292; SBI_ID: SBI-011713
Temperature 308 °C