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ethyl 4-[({[2-chloro-5-(methylsulfanyl)benzoyl]amino}carbothioyl)amino]benzoate
SpectraBase Compound ID HayRtVXu3qR
InChI InChI=1S/C18H17ClN2O3S2/c1-3-24-17(23)11-4-6-12(7-5-11)20-18(25)21-16(22)14-10-13(26-2)8-9-15(14)19/h4-10H,3H2,1-2H3,(H2,20,21,22,25)
InChIKey NBQBBUSTPKVICC-UHFFFAOYSA-N
Mol Weight 408.92 g/mol
Molecular Formula C18H17ClN2O3S2
Exact Mass 408.036912 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Kx4OgYw7j9Q
Name ethyl 4-[({[2-chloro-5-(methylsulfanyl)benzoyl]amino}carbothioyl)amino]benzoate
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/C18H17ClN2O3S2/c1-3-24-17(23)11-4-6-12(7-5-11)20-18(25)21-16(22)14-10-13(26-2)8-9-15(14)19/h4-10H,3H2,1-2H3,(H2,20,21,22,25)
InChIKey NBQBBUSTPKVICC-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6980
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: 9686489; UBI_ID: UBI-006982
Temperature 308 °C