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N-(5-chloro-2-methylphenyl)-2-{[5-(2-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID 4QydO4JAHQS
InChI InChI=1S/C23H17Cl3N4OS/c1-14-6-7-16(25)12-20(14)27-21(31)13-32-23-29-28-22(18-4-2-3-5-19(18)26)30(23)17-10-8-15(24)9-11-17/h2-12H,13H2,1H3,(H,27,31)
InChIKey YOKRVCFYKWQBJS-UHFFFAOYSA-N
Mol Weight 503.84 g/mol
Molecular Formula C23H17Cl3N4OS
Exact Mass 502.018865 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FkkANQ7n3A8
Name N-(5-chloro-2-methylphenyl)-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/C23H17Cl3N4OS/c1-14-6-7-16(25)12-20(14)27-21(31)13-32-23-29-28-22(18-4-2-3-5-19(18)26)30(23)17-10-8-15(24)9-11-17/h2-12H,13H2,1H3,(H,27,31)
InChIKey YOKRVCFYKWQBJS-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14524
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: D98642; Labnumber: GRES-24219; SBI_ID: SBI-014527
Temperature 308 °C