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2-{[4-allyl-5-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[1,1'-biphenyl]-2-ylacetamide

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2-{[4-allyl-5-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[1,1'-biphenyl]-2-ylacetamide
SpectraBase Compound ID LYbIJGYcKHg
InChI InChI=1S/C25H21ClN4OS/c1-2-15-30-24(19-11-8-12-20(26)16-19)28-29-25(30)32-17-23(31)27-22-14-7-6-13-21(22)18-9-4-3-5-10-18/h2-14,16H,1,15,17H2,(H,27,31)
InChIKey VGOQBRAOSRFYRI-UHFFFAOYSA-N
Mol Weight 460.98 g/mol
Molecular Formula C25H21ClN4OS
Exact Mass 460.11246 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AA6XLIS0EVh
Name 2-{[4-allyl-5-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[1,1'-biphenyl]-2-ylacetamide
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/C25H21ClN4OS/c1-2-15-30-24(19-11-8-12-20(26)16-19)28-29-25(30)32-17-23(31)27-22-14-7-6-13-21(22)18-9-4-3-5-10-18/h2-14,16H,1,15,17H2,(H,27,31)
InChIKey VGOQBRAOSRFYRI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11082
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: E05777; Labnumber: GRES-10148; SBI_ID: SBI-011085
Temperature 318 °C