N-phenyl-2-{[4-(2-phenylethyl)-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

SpectraBase Compound ID	82k5XiSwBoV
InChI	InChI=1S/C22H20N4OS2/c27-20(23-18-10-5-2-6-11-18)16-29-22-25-24-21(19-12-7-15-28-19)26(22)14-13-17-8-3-1-4-9-17/h1-12,15H,13-14,16H2,(H,23,27)
InChIKey	PBKCBTXOQPOYII-UHFFFAOYSA-N Google Search
Mol Weight	420.55 g/mol
Molecular Formula	C22H20N4OS2
Exact Mass	420.107854 g/mol

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SpectraBase Spectrum ID	1RWelLYppbI
Name	N-phenyl-2-{[4-(2-phenylethyl)-5-(2-thienyl)-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/C22H20N4OS2/c27-20(23-18-10-5-2-6-11-18)16-29-22-25-24-21(19-12-7-15-28-19)26(22)14-13-17-8-3-1-4-9-17/h1-12,15H,13-14,16H2,(H,23,27)
InChIKey	PBKCBTXOQPOYII-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_29134
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: D91252; Labnumber: VGU-0022749; SBI_ID: SBI-029138
Temperature	318 °C