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N-acetyl-N'-{4-[({[(2E)-3-(2,4-dichlorophenyl)-2-propenoyl]amino}carbothioyl)amino]phenyl}thiourea
SpectraBase Compound ID 2dC9OuX1fwT
InChI InChI=1S/C19H16Cl2N4O2S2/c1-11(26)22-18(28)23-14-5-7-15(8-6-14)24-19(29)25-17(27)9-3-12-2-4-13(20)10-16(12)21/h2-10H,1H3,(H2,22,23,26,28)(H2,24,25,27,29)/b9-3+
InChIKey QVBHEFVPIFYKRD-YCRREMRBSA-N
Mol Weight 467.39 g/mol
Molecular Formula C19H16Cl2N4O2S2
Exact Mass 466.009174 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7CNh5Pk2yOl
Name N-acetyl-N'-{4-[({[(2E)-3-(2,4-dichlorophenyl)-2-propenoyl]amino}carbothioyl)amino]phenyl}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/C19H16Cl2N4O2S2/c1-11(26)22-18(28)23-14-5-7-15(8-6-14)24-19(29)25-17(27)9-3-12-2-4-13(20)10-16(12)21/h2-10H,1H3,(H2,22,23,26,28)(H2,24,25,27,29)/b9-3+
InChIKey QVBHEFVPIFYKRD-YCRREMRBSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2611
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: D03753; Labnumber: SPMOS1-26715; SBI_ID: SBI-002613
Synonyms N-acetyl-N'-{4-[({[3-(2,4-dichlorophenyl)-2-propenoyl]amino}carbothioyl)amino]phenyl}thiourea
Temperature 308 °C