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

SpectraBase Compound ID	KYDmszSNQiw
InChI	InChI=1S/C22H18ClN5OS/c1-15-12-17(23)9-10-19(15)25-20(29)14-30-22-27-26-21(16-6-5-11-24-13-16)28(22)18-7-3-2-4-8-18/h2-13H,14H2,1H3,(H,25,29)
InChIKey	QBLUIXLQOCYGBE-UHFFFAOYSA-N Google Search
Mol Weight	435.93 g/mol
Molecular Formula	C22H18ClN5OS
Exact Mass	435.092059 g/mol

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SpectraBase Spectrum ID	Fn900hzaSMu
Name	N-(4-chloro-2-methylphenyl)-2-{[4-phenyl-5-(3-pyridinyl)-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/C22H18ClN5OS/c1-15-12-17(23)9-10-19(15)25-20(29)14-30-22-27-26-21(16-6-5-11-24-13-16)28(22)18-7-3-2-4-8-18/h2-13H,14H2,1H3,(H,25,29)
InChIKey	QBLUIXLQOCYGBE-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_27376
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: D76303; Labnumber: MOR-8656; SBI_ID: SBI-027380
Temperature	308 °C