acetic acid, [[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-1-(3-nitrophenyl)ethylidene]hydrazide

SpectraBase Compound ID	8Q8EDI8UPSX
InChI	InChI=1S/C25H22N6O3S/c1-17-11-13-21(14-12-17)30-24(19-7-4-3-5-8-19)28-29-25(30)35-16-23(32)27-26-18(2)20-9-6-10-22(15-20)31(33)34/h3-15H,16H2,1-2H3,(H,27,32)/b26-18+
InChIKey	CRQRCCBJQNDOOR-NLRVBDNBSA-N Google Search
Mol Weight	486.55 g/mol
Molecular Formula	C25H22N6O3S
Exact Mass	486.14741 g/mol

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SpectraBase Spectrum ID	D9K4bRPd4Vf
Name	acetic acid, [[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-1-(3-nitrophenyl)ethylidene]hydrazide
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/C25H22N6O3S/c1-17-11-13-21(14-12-17)30-24(19-7-4-3-5-8-19)28-29-25(30)35-16-23(32)27-26-18(2)20-9-6-10-22(15-20)31(33)34/h3-15H,16H2,1-2H3,(H,27,32)/b26-18+
InChIKey	CRQRCCBJQNDOOR-NLRVBDNBSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_4789
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: NMR/10248128