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

SpectraBase Compound ID	CcKFxr2YMkg
InChI	InChI=1S/C22H19N9O2S/c1-13-6-8-15(9-7-13)34-12-18-19(26-30-31(18)21-20(23)28-33-29-21)22(32)27-25-11-14-10-24-17-5-3-2-4-16(14)17/h2-11,24H,12H2,1H3,(H2,23,28)(H,27,32)/b25-11+
InChIKey	UHCPHQLAQSCODA-OPEKNORGSA-N Google Search
Mol Weight	473.52 g/mol
Molecular Formula	C22H19N9O2S
Exact Mass	473.138242 g/mol

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SpectraBase Spectrum ID	5crUkSdRa39
Name	1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-1H-indol-3-ylmethylidene]-5-{[(4-methylphenyl)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/C22H19N9O2S/c1-13-6-8-15(9-7-13)34-12-18-19(26-30-31(18)21-20(23)28-33-29-21)22(32)27-25-11-14-10-24-17-5-3-2-4-16(14)17/h2-11,24H,12H2,1H3,(H2,23,28)(H,27,32)/b25-11+
InChIKey	UHCPHQLAQSCODA-OPEKNORGSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_28066
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: D80254; Labnumber: NIG2-1954; SBI_ID: SBI-028070
Synonyms	1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[1H-indol-3-ylmethylidene]-5-{[(4-methylphenyl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Temperature	318 °C