| SpectraBase Spectrum ID |
D6idE4HCxUP |
| Name |
ethyl 4-{[({4-[(4-bromo-1H-pyrazol-1-yl)methyl]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/C21H19BrN4O3S/c1-2-29-20(28)16-7-9-18(10-8-16)24-21(30)25-19(27)15-5-3-14(4-6-15)12-26-13-17(22)11-23-26/h3-11,13H,2,12H2,1H3,(H2,24,25,27,30) |
| InChIKey |
HMACXKWNKLLJOT-UHFFFAOYSA-N |
| NMR Offset |
14.9921 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_UBI_21270_4467 |
| 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: 9676319; UBI_ID: UBI-004468 |
| Temperature |
313 °C |
![ethyl 4-{[({4-[(4-bromo-1H-pyrazol-1-yl)methyl]benzoyl}amino)carbothioyl]amino}benzoate](/api/spectrum/D6idE4HCxUP/structure.png?h=300&w=458 "ethyl 4-{[({4-[(4-bromo-1H-pyrazol-1-yl)methyl]benzoyl}amino)carbothioyl]amino}benzoate")
