N-{4-[(4-bromo-1H-pyrazol-1-yl)methyl]benzoyl}-N'-(4-iodophenyl)thiourea

SpectraBase Compound ID	D8Oj6qgiKDB
InChI	InChI=1S/C18H14BrIN4OS/c19-14-9-21-24(11-14)10-12-1-3-13(4-2-12)17(25)23-18(26)22-16-7-5-15(20)6-8-16/h1-9,11H,10H2,(H2,22,23,25,26)
InChIKey	MNGMAFSLWFKTIM-UHFFFAOYSA-N Google Search
Mol Weight	541.21 g/mol
Molecular Formula	C18H14BrIN4OS
Exact Mass	539.91164 g/mol

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SpectraBase Spectrum ID	HZmNvP9FKsw
Name	N-{4-[(4-bromo-1H-pyrazol-1-yl)methyl]benzoyl}-N'-(4-iodophenyl)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/C18H14BrIN4OS/c19-14-9-21-24(11-14)10-12-1-3-13(4-2-12)17(25)23-18(26)22-16-7-5-15(20)6-8-16/h1-9,11H,10H2,(H2,22,23,25,26)
InChIKey	MNGMAFSLWFKTIM-UHFFFAOYSA-N
NMR Offset	14.9921
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_4469
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: 9681163; UBI_ID: UBI-004470
Temperature	313 °C