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2-{[5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-mesitylacetamide

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2-{[5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-mesitylacetamide
SpectraBase Compound ID 4EPHSxgUP2c
InChI InChI=1S/C26H25ClN4OS/c1-16-9-11-20(12-10-16)31-25(21-7-5-6-8-22(21)27)29-30-26(31)33-15-23(32)28-24-18(3)13-17(2)14-19(24)4/h5-14H,15H2,1-4H3,(H,28,32)
InChIKey YHCHRLVQRDMDKJ-UHFFFAOYSA-N
Mol Weight 477.03 g/mol
Molecular Formula C26H25ClN4OS
Exact Mass 476.14376 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4Puny4fecOe
Name 2-{[5-(2-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-mesitylacetamide
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/C26H25ClN4OS/c1-16-9-11-20(12-10-16)31-25(21-7-5-6-8-22(21)27)29-30-26(31)33-15-23(32)28-24-18(3)13-17(2)14-19(24)4/h5-14H,15H2,1-4H3,(H,28,32)
InChIKey YHCHRLVQRDMDKJ-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14351
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: D98245; Labnumber: GRES-17897; SBI_ID: SBI-014354
Temperature 308 °C