| SpectraBase Spectrum ID |
LnW1N2LyRHY |
| Name |
methyl 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/C20H17BrN4O3S/c1-28-19(27)15-6-8-17(9-7-15)23-20(29)24-18(26)14-4-2-13(3-5-14)11-25-12-16(21)10-22-25/h2-10,12H,11H2,1H3,(H2,23,24,26,29) |
| InChIKey |
YKDTWTAOAUJLAP-UHFFFAOYSA-N |
| NMR Offset |
14.9921 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_UBI_21270_4466 |
| 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: 9679832; UBI_ID: UBI-004467 |
| Temperature |
313 °C |
![methyl 4-{[({4-[(4-bromo-1H-pyrazol-1-yl)methyl]benzoyl}amino)carbothioyl]amino}benzoate](/api/spectrum/LnW1N2LyRHY/structure.png?h=300&w=458 "methyl 4-{[({4-[(4-bromo-1H-pyrazol-1-yl)methyl]benzoyl}amino)carbothioyl]amino}benzoate")
