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N-[4-(acetylamino)phenyl]-2-{[5-(2-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID 5qNSt7ftCcC
InChI InChI=1S/C24H19Cl2N5O2S/c1-15(32)27-17-8-10-18(11-9-17)28-22(33)14-34-24-30-29-23(20-4-2-3-5-21(20)26)31(24)19-12-6-16(25)7-13-19/h2-13H,14H2,1H3,(H,27,32)(H,28,33)
InChIKey QQAXERCIZQFWCS-UHFFFAOYSA-N
Mol Weight 512.42 g/mol
Molecular Formula C24H19Cl2N5O2S
Exact Mass 511.063651 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 936iONOXugg
Name N-[4-(acetylamino)phenyl]-2-{[5-(2-chlorophenyl)-4-(4-chlorophenyl)-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/C24H19Cl2N5O2S/c1-15(32)27-17-8-10-18(11-9-17)28-22(33)14-34-24-30-29-23(20-4-2-3-5-21(20)26)31(24)19-12-6-16(25)7-13-19/h2-13H,14H2,1H3,(H,27,32)(H,28,33)
InChIKey QQAXERCIZQFWCS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4900
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: E08336; Labnumber: GRES-36939; SBI_ID: SBI-004902
Temperature 318 °C