1-(3,4-dihydroxyphenyl)-2-{[4-(2-furylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone

SpectraBase Compound ID	95st5YN0rw9
InChI	InChI=1S/C22H19N3O4S/c1-14-4-2-5-16(10-14)21-23-24-22(25(21)12-17-6-3-9-29-17)30-13-20(28)15-7-8-18(26)19(27)11-15/h2-11,26-27H,12-13H2,1H3
InChIKey	HRHYRNXSIAWLSW-UHFFFAOYSA-N Google Search
Mol Weight	421.47 g/mol
Molecular Formula	C22H19N3O4S
Exact Mass	421.109627 g/mol

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SpectraBase Spectrum ID	5eDf7YXGAXB
Name	1-(3,4-dihydroxyphenyl)-2-{[4-(2-furylmethyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
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/C22H19N3O4S/c1-14-4-2-5-16(10-14)21-23-24-22(25(21)12-17-6-3-9-29-17)30-13-20(28)15-7-8-18(26)19(27)11-15/h2-11,26-27H,12-13H2,1H3
InChIKey	HRHYRNXSIAWLSW-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_11743
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: E08690; Labnumber: GRES-37354; SBI_ID: SBI-011746
Temperature	308 °C