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

SpectraBase Compound ID	LFEeGs6pVTI
InChI	InChI=1S/C17H15N11O4S/c1-27-7-20-23-17(27)33-6-10-13(21-26-28(10)15-14(18)24-32-25-15)16(29)22-19-5-9-2-3-11-12(4-9)31-8-30-11/h2-5,7H,6,8H2,1H3,(H2,18,24)(H,22,29)/b19-5+
InChIKey	DNNHQSXYBXRNAC-PTXOJBNSSA-N Google Search
Mol Weight	469.44 g/mol
Molecular Formula	C17H15N11O4S
Exact Mass	469.102919 g/mol

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SpectraBase Spectrum ID	I9tsiMZrVyI
Name	1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-1,3-benzodioxol-5-ylmethylidene]-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/C17H15N11O4S/c1-27-7-20-23-17(27)33-6-10-13(21-26-28(10)15-14(18)24-32-25-15)16(29)22-19-5-9-2-3-11-12(4-9)31-8-30-11/h2-5,7H,6,8H2,1H3,(H2,18,24)(H,22,29)/b19-5+
InChIKey	DNNHQSXYBXRNAC-PTXOJBNSSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_28406
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: D81477; Labnumber: NIG2-2334; SBI_ID: SBI-028410
Synonyms	1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[1,3-benzodioxol-5-ylmethylidene]-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Temperature	318 °C