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N-(3-chloro-4-methoxyphenyl)-2-{[5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID Lb9kA1XfszT
InChI InChI=1S/C24H20Cl2N4O2S/c1-15-7-10-17(11-8-15)30-23(18-5-3-4-6-19(18)25)28-29-24(30)33-14-22(31)27-16-9-12-21(32-2)20(26)13-16/h3-13H,14H2,1-2H3,(H,27,31)
InChIKey IHMLCUAFUVAASA-UHFFFAOYSA-N
Mol Weight 499.42 g/mol
Molecular Formula C24H20Cl2N4O2S
Exact Mass 498.068402 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2fU8CpAhVrY
Name N-(3-chloro-4-methoxyphenyl)-2-{[5-(2-chlorophenyl)-4-(4-methylphenyl)-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/C24H20Cl2N4O2S/c1-15-7-10-17(11-8-15)30-23(18-5-3-4-6-19(18)25)28-29-24(30)33-14-22(31)27-16-9-12-21(32-2)20(26)13-16/h3-13H,14H2,1-2H3,(H,27,31)
InChIKey IHMLCUAFUVAASA-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14504
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: D98613; Labnumber: GRES-23648; SBI_ID: SBI-014507
Temperature 308 °C