1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-isopropoxyphenyl)methylidene]-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide

SpectraBase Compound ID	15BQb3xshkU
InChI	InChI=1S/C19H21N11O3S/c1-11(2)32-13-6-4-12(5-7-13)8-21-24-18(31)15-14(9-34-19-25-22-10-29(19)3)30(28-23-15)17-16(20)26-33-27-17/h4-8,10-11H,9H2,1-3H3,(H2,20,26)(H,24,31)/b21-8+
InChIKey	FJUCFEJMQQHFGT-ODCIPOBUSA-N Google Search
Mol Weight	483.51 g/mol
Molecular Formula	C19H21N11O3S
Exact Mass	483.154955 g/mol

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SpectraBase Spectrum ID	38Dq3VFz5OF
Name	1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-isopropoxyphenyl)methylidene]-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]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/C19H21N11O3S/c1-11(2)32-13-6-4-12(5-7-13)8-21-24-18(31)15-14(9-34-19-25-22-10-29(19)3)30(28-23-15)17-16(20)26-33-27-17/h4-8,10-11H,9H2,1-3H3,(H2,20,26)(H,24,31)/b21-8+
InChIKey	FJUCFEJMQQHFGT-ODCIPOBUSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_13099
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: D79957; Labnumber: NIG2-0268; SBI_ID: SBI-013102
Synonyms	1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(4-isopropoxyphenyl)methylidene]-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Temperature	315 °C