N-[2-(3-bromo-4-methoxyphenyl)-1,3-benzoxazol-5-yl]-N'-(4-butoxybenzoyl)thiourea

SpectraBase Compound ID	4RemtK1Kfno
InChI	InChI=1S/C26H24BrN3O4S/c1-3-4-13-33-19-9-5-16(6-10-19)24(31)30-26(35)28-18-8-12-23-21(15-18)29-25(34-23)17-7-11-22(32-2)20(27)14-17/h5-12,14-15H,3-4,13H2,1-2H3,(H2,28,30,31,35)
InChIKey	RJEPAPNVMSGKEZ-UHFFFAOYSA-N Google Search
Mol Weight	554.46 g/mol
Molecular Formula	C26H24BrN3O4S
Exact Mass	553.06709 g/mol

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SpectraBase Spectrum ID	Y8jm1f1mbE
Name	N-[2-(3-bromo-4-methoxyphenyl)-1,3-benzoxazol-5-yl]-N'-(4-butoxybenzoyl)thiourea
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/C26H24BrN3O4S/c1-3-4-13-33-19-9-5-16(6-10-19)24(31)30-26(35)28-18-8-12-23-21(15-18)29-25(34-23)17-7-11-22(32-2)20(27)14-17/h5-12,14-15H,3-4,13H2,1-2H3,(H2,28,30,31,35)
InChIKey	RJEPAPNVMSGKEZ-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_6678
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: 63099; UBI_ID: UBI-006680
Temperature	315 °C