2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,3-dichlorophenyl)methylidene]acetohydrazide

SpectraBase Compound ID	8Q0PUCpK6LT
InChI	InChI=1S/C28H27Cl2N5O2S/c1-28(2,3)20-10-8-18(9-11-20)26-33-34-27(35(26)21-12-14-22(37-4)15-13-21)38-17-24(36)32-31-16-19-6-5-7-23(29)25(19)30/h5-16H,17H2,1-4H3,(H,32,36)/b31-16+
InChIKey	ICAXMQLMYNGXIH-WCMJOSRZSA-N Google Search
Mol Weight	568.52 g/mol
Molecular Formula	C28H27Cl2N5O2S
Exact Mass	567.126252 g/mol

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SpectraBase Spectrum ID	I0hjIf797up
Name	2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,3-dichlorophenyl)methylidene]acetohydrazide
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/C28H27Cl2N5O2S/c1-28(2,3)20-10-8-18(9-11-20)26-33-34-27(35(26)21-12-14-22(37-4)15-13-21)38-17-24(36)32-31-16-19-6-5-7-23(29)25(19)30/h5-16H,17H2,1-4H3,(H,32,36)/b31-16+
InChIKey	ICAXMQLMYNGXIH-WCMJOSRZSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_6676
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: D23926; Labnumber: GRES-01650; SBI_ID: SBI-006679
Synonyms	2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2,3-dichlorophenyl)methylidene]acetohydrazide
Temperature	318 °C