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

SpectraBase Compound ID	2mqC3g7M4CK
InChI	InChI=1S/C23H23N9O4/c1-3-31(4-2)16-8-5-14(6-9-16)12-25-27-23(33)19-20(15-7-10-17-18(11-15)35-13-34-17)32(30-26-19)22-21(24)28-36-29-22/h5-12H,3-4,13H2,1-2H3,(H2,24,28)(H,27,33)/b25-12+
InChIKey	HAJNBRLFVHTZEB-BRJLIKDPSA-N Google Search
Mol Weight	489.5 g/mol
Molecular Formula	C23H23N9O4
Exact Mass	489.1873 g/mol

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SpectraBase Spectrum ID	AWIyFtMbbe1
Name	1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-{(E)-[4-(diethylamino)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/C23H23N9O4/c1-3-31(4-2)16-8-5-14(6-9-16)12-25-27-23(33)19-20(15-7-10-17-18(11-15)35-13-34-17)32(30-26-19)22-21(24)28-36-29-22/h5-12H,3-4,13H2,1-2H3,(H2,24,28)(H,27,33)/b25-12+
InChIKey	HAJNBRLFVHTZEB-BRJLIKDPSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_13761
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: D90259; Labnumber: MROZ-1571; SBI_ID: SBI-013764
Synonyms	1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-{[4-(diethylamino)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Temperature	318 °C