2-{(E)-[({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazono]methyl}benzoic acid

SpectraBase Compound ID	115AWPBF2Ub
InChI	InChI=1S/C20H16N8O4S/c21-17-18(26-32-25-17)28-15(11-33-13-7-2-1-3-8-13)16(23-27-28)19(29)24-22-10-12-6-4-5-9-14(12)20(30)31/h1-10H,11H2,(H2,21,25)(H,24,29)(H,30,31)/b22-10+
InChIKey	FHCRGTKUHCNBAV-LSHDLFTRSA-N Google Search
Mol Weight	464.46 g/mol
Molecular Formula	C20H16N8O4S
Exact Mass	464.101522 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	CEVnxp2tbyB
Name	2-{(E)-[({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazono]methyl}benzoic acid
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/C20H16N8O4S/c21-17-18(26-32-25-17)28-15(11-33-13-7-2-1-3-8-13)16(23-27-28)19(29)24-22-10-12-6-4-5-9-14(12)20(30)31/h1-10H,11H2,(H2,21,25)(H,24,29)(H,30,31)/b22-10+
InChIKey	FHCRGTKUHCNBAV-LSHDLFTRSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_25150
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: D49271; Labnumber: NIG1-3091; SBI_ID: SBI-025154
Synonyms	2-{[({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazono]methyl}benzoic acid
Temperature	300 °C