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N-[1-(4-bromobenzyl)-1H-pyrazol-4-yl]-N'-(4-methyl-2-oxo-2H-chromen-7-yl)thiourea

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N-[1-(4-bromobenzyl)-1H-pyrazol-4-yl]-N'-(4-methyl-2-oxo-2H-chromen-7-yl)thiourea
SpectraBase Compound ID 2xwMAZkmbNn
InChI InChI=1S/C21H17BrN4O2S/c1-13-8-20(27)28-19-9-16(6-7-18(13)19)24-21(29)25-17-10-23-26(12-17)11-14-2-4-15(22)5-3-14/h2-10,12H,11H2,1H3,(H2,24,25,29)
InChIKey PRERSHVLDYTBIG-UHFFFAOYSA-N
Mol Weight 469.36 g/mol
Molecular Formula C21H17BrN4O2S
Exact Mass 468.02556 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9Ou12gwExqr
Name N-[1-(4-bromobenzyl)-1H-pyrazol-4-yl]-N'-(4-methyl-2-oxo-2H-chromen-7-yl)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/C21H17BrN4O2S/c1-13-8-20(27)28-19-9-16(6-7-18(13)19)24-21(29)25-17-10-23-26(12-17)11-14-2-4-15(22)5-3-14/h2-10,12H,11H2,1H3,(H2,24,25,29)
InChIKey PRERSHVLDYTBIG-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_30073
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: 1635293; SBI_ID: SBI-030077
Temperature 318 °C