For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
butyl 4-[({[(4-chloro-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}carbothioyl)amino]benzoate
SpectraBase Compound ID 843vak3QbUj
InChI InChI=1S/C17H19ClN4O3S/c1-3-4-9-25-16(24)11-5-7-12(8-6-11)20-17(26)21-15(23)14-13(18)10-19-22(14)2/h5-8,10H,3-4,9H2,1-2H3,(H2,20,21,23,26)
InChIKey MBTJEFJSHOVZID-UHFFFAOYSA-N
Mol Weight 394.88 g/mol
Molecular Formula C17H19ClN4O3S
Exact Mass 394.086639 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Fss9sHikbxf
Name butyl 4-[({[(4-chloro-1-methyl-1H-pyrazol-5-yl)carbonyl]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/C17H19ClN4O3S/c1-3-4-9-25-16(24)11-5-7-12(8-6-11)20-17(26)21-15(23)14-13(18)10-19-22(14)2/h5-8,10H,3-4,9H2,1-2H3,(H2,20,21,23,26)
InChIKey MBTJEFJSHOVZID-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_16230
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: UZI/1009986; Labnumber: OBM0457; UZI_ID: UZI-016234
Temperature 313 °C