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N-(3-chlorophenyl)-2-{[5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID DBCmfmBraT6
InChI InChI=1S/C23H18Cl2N4OS/c1-15-9-11-18(12-10-15)29-22(19-7-2-3-8-20(19)25)27-28-23(29)31-14-21(30)26-17-6-4-5-16(24)13-17/h2-13H,14H2,1H3,(H,26,30)
InChIKey VQRZKLXYQACMJE-UHFFFAOYSA-N
Mol Weight 469.39 g/mol
Molecular Formula C23H18Cl2N4OS
Exact Mass 468.057838 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 97TUmVSGTrm
Name N-(3-chlorophenyl)-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/C23H18Cl2N4OS/c1-15-9-11-18(12-10-15)29-22(19-7-2-3-8-20(19)25)27-28-23(29)31-14-21(30)26-17-6-4-5-16(24)13-17/h2-13H,14H2,1H3,(H,26,30)
InChIKey VQRZKLXYQACMJE-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14513
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: D98623; Labnumber: GRES-23822; SBI_ID: SBI-014516
Temperature 308 °C