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N-[3-MERCAPTO-5-(2-THIENYL)-1,2,4-TRIAZOL-4-YL]-N'-(4-BROMOROPHENYL)-THIOUREA

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N-[3-MERCAPTO-5-(2-THIENYL)-1,2,4-TRIAZOL-4-YL]-N'-(4-BROMOROPHENYL)-THIOUREA
SpectraBase Compound ID 4Da9vkZLyBo
InChI InChI=1S/C13H10BrN5S3/c14-8-3-5-9(6-4-8)15-12(20)18-19-11(16-17-13(19)21)10-2-1-7-22-10/h1-7H,(H,17,21)(H2,15,18,20)
InChIKey UHTMKRBABVKUHR-UHFFFAOYSA-N
Mol Weight 412.34 g/mol
Molecular Formula C13H10BrN5S3
Exact Mass 410.928172 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 55hecEq0wpp
Name N-[3-MERCAPTO-5-(2-THIENYL)-1,2,4-TRIAZOL-4-YL]-N'-(4-BROMOROPHENYL)-THIOUREA
Compound Number 4E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H10BrN5S3
InChI InChI=1S/C13H10BrN5S3/c14-8-3-5-9(6-4-8)15-12(20)18-19-11(16-17-13(19)21)10-2-1-7-22-10/h1-7H,(H,17,21)(H2,15,18,20)
InChIKey UHTMKRBABVKUHR-UHFFFAOYSA-N
Literature Reference Author M.A.AL-OMAR
Literature Reference Citation MOLECULES,15,502(2010)
Literature Reference DOI 10.3390/molecules15010502
Molecular Weight 412.340 g/mol
Sample ID 69176
Solvent Unknown