5-{[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl 4-bromobenzoate

SpectraBase Compound ID	6lNp0R1amiS
InChI	InChI=1S/C19H14BrN3O6S/c20-12-3-1-11(2-4-12)17(25)28-18-22-23-19(29-18)30-10-16(24)21-13-5-6-14-15(9-13)27-8-7-26-14/h1-6,9H,7-8,10H2,(H,21,24)
InChIKey	WLWVEPLLPCZGJX-UHFFFAOYSA-N Google Search
Mol Weight	492.3 g/mol
Molecular Formula	C19H14BrN3O6S
Exact Mass	490.978669 g/mol

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SpectraBase Spectrum ID	AcgUl3NpSHm
Name	5-{[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]sulfanyl}-1,3,4-oxadiazol-2-yl 4-bromobenzoate
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/C19H14BrN3O6S/c20-12-3-1-11(2-4-12)17(25)28-18-22-23-19(29-18)30-10-16(24)21-13-5-6-14-15(9-13)27-8-7-26-14/h1-6,9H,7-8,10H2,(H,21,24)
InChIKey	WLWVEPLLPCZGJX-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_5552
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: NMR/11221784; Labnumber: 0749; IOH_ID: IOH-005553