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

SpectraBase Compound ID	1XdzCwLPDxo
InChI	InChI=1S/C17H14F3N11O2S/c1-30-8-23-26-16(30)34-7-11-12(24-29-31(11)14-13(21)27-33-28-14)15(32)25-22-6-9-2-4-10(5-3-9)17(18,19)20/h2-6,8H,7H2,1H3,(H2,21,27)(H,25,32)/b22-6+
InChIKey	INHQOTHKERSGHA-GEVRCRHISA-N Google Search
Mol Weight	493.43 g/mol
Molecular Formula	C17H14F3N11O2S
Exact Mass	493.100474 g/mol

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SpectraBase Spectrum ID	HqP8kZWXBmY
Name	1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}-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/C17H14F3N11O2S/c1-30-8-23-26-16(30)34-7-11-12(24-29-31(11)14-13(21)27-33-28-14)15(32)25-22-6-9-2-4-10(5-3-9)17(18,19)20/h2-6,8H,7H2,1H3,(H2,21,27)(H,25,32)/b22-6+
InChIKey	INHQOTHKERSGHA-GEVRCRHISA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_28392
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: D81446; Labnumber: NIG2-1696; SBI_ID: SBI-028396
Synonyms	1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-N'-{[4-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Temperature	318 °C