1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-chloro-6-fluorophenyl)methylidene]-5-[(methylanilino)methyl]-1H-1,2,3-triazole-4-carbohydrazide

SpectraBase Compound ID	DM4C1oiGsfF
InChI	InChI=1S/C20H17ClFN9O2/c1-30(12-6-3-2-4-7-12)11-16-17(25-29-31(16)19-18(23)27-33-28-19)20(32)26-24-10-13-14(21)8-5-9-15(13)22/h2-10H,11H2,1H3,(H2,23,27)(H,26,32)/b24-10+
InChIKey	UHULVZDQLIXKRZ-YSURURNPSA-N Google Search
Mol Weight	469.87 g/mol
Molecular Formula	C20H17ClFN9O2
Exact Mass	469.117777 g/mol

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SpectraBase Spectrum ID	FonW1ZpogXJ
Name	1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-chloro-6-fluorophenyl)methylidene]-5-[(methylanilino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
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/C20H17ClFN9O2/c1-30(12-6-3-2-4-7-12)11-16-17(25-29-31(16)19-18(23)27-33-28-19)20(32)26-24-10-13-14(21)8-5-9-15(13)22/h2-10H,11H2,1H3,(H2,23,27)(H,26,32)/b24-10+
InChIKey	UHULVZDQLIXKRZ-YSURURNPSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_8493
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: E12229; Labnumber: MROZ-1284; SBI_ID: SBI-008496
Synonyms	1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2-chloro-6-fluorophenyl)methylidene]-5-[(methylanilino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Temperature	318 °C