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3-chloro-N-{4-[({[(4-chlorophenyl)acetyl]amino}carbothioyl)amino]phenyl}benzamide
SpectraBase Compound ID HztImpbj7IY
InChI InChI=1S/C22H17Cl2N3O2S/c23-16-6-4-14(5-7-16)12-20(28)27-22(30)26-19-10-8-18(9-11-19)25-21(29)15-2-1-3-17(24)13-15/h1-11,13H,12H2,(H,25,29)(H2,26,27,28,30)
InChIKey DTBPIRXMYLLRHR-UHFFFAOYSA-N
Mol Weight 458.36 g/mol
Molecular Formula C22H17Cl2N3O2S
Exact Mass 457.041853 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HB6FpcseFiy
Name 3-chloro-N-{4-[({[(4-chlorophenyl)acetyl]amino}carbothioyl)amino]phenyl}benzamide
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/C22H17Cl2N3O2S/c23-16-6-4-14(5-7-16)12-20(28)27-22(30)26-19-10-8-18(9-11-19)25-21(29)15-2-1-3-17(24)13-15/h1-11,13H,12H2,(H,25,29)(H2,26,27,28,30)
InChIKey DTBPIRXMYLLRHR-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_356
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: /VSVE061895; UBI_ID: UBI-000357
Temperature 308 °C