2-{[4-allyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-butylphenyl)acetamide

SpectraBase Compound ID	9b19Op5HiLw
InChI	InChI=1S/C24H28N4O2S/c1-4-6-7-18-8-12-20(13-9-18)25-22(29)17-31-24-27-26-23(28(24)16-5-2)19-10-14-21(30-3)15-11-19/h5,8-15H,2,4,6-7,16-17H2,1,3H3,(H,25,29)
InChIKey	CYQBTIOVVIGZQO-UHFFFAOYSA-N Google Search
Mol Weight	436.57 g/mol
Molecular Formula	C24H28N4O2S
Exact Mass	436.193297 g/mol

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SpectraBase Spectrum ID	HhQvjFYnLZR
Name	2-{[4-allyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-butylphenyl)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/C24H28N4O2S/c1-4-6-7-18-8-12-20(13-9-18)25-22(29)17-31-24-27-26-23(28(24)16-5-2)19-10-14-21(30-3)15-11-19/h5,8-15H,2,4,6-7,16-17H2,1,3H3,(H,25,29)
InChIKey	CYQBTIOVVIGZQO-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_11729
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: E08667; Labnumber: GRES-37329; SBI_ID: SBI-011732
Temperature	308 °C