2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(tetrahydro-2-furanylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(Z)-1-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)ethylidene]acetohydrazide

SpectraBase Compound ID	BjecC4KhlCj
InChI	InChI=1S/C22H27N7O5S/c1-12-8-16(27-28(12)4)20-25-26-22(29(20)10-15-6-5-7-33-15)35-11-18(31)24-23-14(3)19-17(30)9-13(2)34-21(19)32/h8-9,15,30H,5-7,10-11H2,1-4H3,(H,24,31)/b23-14-
InChIKey	CYZHNGUMXPMBBJ-UCQKPKSFSA-N Google Search
Mol Weight	501.56 g/mol
Molecular Formula	C22H27N7O5S
Exact Mass	501.179438 g/mol

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SpectraBase Spectrum ID	3xkS4ucchG9
Name	2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(tetrahydro-2-furanylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(Z)-1-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)ethylidene]acetohydrazide
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/C22H27N7O5S/c1-12-8-16(27-28(12)4)20-25-26-22(29(20)10-15-6-5-7-33-15)35-11-18(31)24-23-14(3)19-17(30)9-13(2)34-21(19)32/h8-9,15,30H,5-7,10-11H2,1-4H3,(H,24,31)/b23-14-
InChIKey	CYZHNGUMXPMBBJ-UCQKPKSFSA-N
NMR Offset	18.4433
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_29722
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: 1100011; SBI_ID: SBI-029726
Synonyms	2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(tetrahydro-2-furanylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[1-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)ethylidene]acetohydrazide
Temperature	318 °C