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

SpectraBase Compound ID	KKw8tMTG6UO
InChI	InChI=1S/C23H26N4O4S/c1-5-10-27-21(14-31-18-8-6-16(2)7-9-18)25-26-23(27)32-15-22(28)24-17-11-19(29-3)13-20(12-17)30-4/h5-9,11-13H,1,10,14-15H2,2-4H3,(H,24,28)
InChIKey	VRHIHVGAYRWIJS-UHFFFAOYSA-N Google Search
Mol Weight	454.55 g/mol
Molecular Formula	C23H26N4O4S
Exact Mass	454.167477 g/mol

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SpectraBase Spectrum ID	1FexTgKmQOZ
Name	2-({4-allyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3,5-dimethoxyphenyl)acetamide
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C23H26N4O4S/c1-5-10-27-21(14-31-18-8-6-16(2)7-9-18)25-26-23(27)32-15-22(28)24-17-11-19(29-3)13-20(12-17)30-4/h5-9,11-13H,1,10,14-15H2,2-4H3,(H,24,28)
InChIKey	VRHIHVGAYRWIJS-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_11341
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: E06649; Labnumber: GRES-26799; SBI_ID: SBI-011344
Temperature	308 °C