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N-[(2E)-3-(5-bromo-2-methoxyphenyl)-2-propenoyl]-N'-[4-(3-bromo-4-methoxyphenyl)-1,3-thiazol-2-yl]thiourea
SpectraBase Compound ID BoGMRDN2PNs
InChI InChI=1S/C21H17Br2N3O3S2/c1-28-17-7-5-14(22)9-13(17)4-8-19(27)25-20(30)26-21-24-16(11-31-21)12-3-6-18(29-2)15(23)10-12/h3-11H,1-2H3,(H2,24,25,26,27,30)/b8-4+
InChIKey YYXSRBBTLYUILP-XBXARRHUSA-N
Mol Weight 583.31 g/mol
Molecular Formula C21H17Br2N3O3S2
Exact Mass 580.90781 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1CyL6Cx55gt
Name N-[(2E)-3-(5-bromo-2-methoxyphenyl)-2-propenoyl]-N'-[4-(3-bromo-4-methoxyphenyl)-1,3-thiazol-2-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/C21H17Br2N3O3S2/c1-28-17-7-5-14(22)9-13(17)4-8-19(27)25-20(30)26-21-24-16(11-31-21)12-3-6-18(29-2)15(23)10-12/h3-11H,1-2H3,(H2,24,25,26,27,30)/b8-4+
InChIKey YYXSRBBTLYUILP-XBXARRHUSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_10837
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: E03205; Labnumber: SPMOS1-26583; SBI_ID: SBI-010840
Synonyms N-[3-(5-bromo-2-methoxyphenyl)-2-propenoyl]-N'-[4-(3-bromo-4-methoxyphenyl)-1,3-thiazol-2-yl]thiourea
Temperature 318 °C