1H-1,2,3-triazole-4-carboxylic acid, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-phenyl-1-piperazinyl)methyl]-, ethyl ester

SpectraBase Compound ID	CmxflCkhESH
InChI	InChI=1S/C18H22N8O3/c1-2-28-18(27)15-14(26(23-20-15)17-16(19)21-29-22-17)12-24-8-10-25(11-9-24)13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3,(H2,19,21)
InChIKey	YBUGVXQMJFRLRU-UHFFFAOYSA-N Google Search
Mol Weight	398.43 g/mol
Molecular Formula	C18H22N8O3
Exact Mass	398.181487 g/mol

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SpectraBase Spectrum ID	Dl6XnK01AkG
Name	1H-1,2,3-triazole-4-carboxylic acid, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-phenyl-1-piperazinyl)methyl]-, ethyl ester
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/C18H22N8O3/c1-2-28-18(27)15-14(26(23-20-15)17-16(19)21-29-22-17)12-24-8-10-25(11-9-24)13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3,(H2,19,21)
InChIKey	YBUGVXQMJFRLRU-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_8516_7841
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: ZERO/003025; IOH_ID: IOH-014846