| SpectraBase Spectrum ID |
1pakKCPBsEm |
| Name |
methyl 2-[({1-[(4-bromo-1H-pyrazol-1-yl)methyl]-1H-pyrazol-3-yl}carbonyl)amino]-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| 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/C22H26BrN5O3S/c1-22(2,3)13-5-6-15-17(9-13)32-20(18(15)21(30)31-4)25-19(29)16-7-8-27(26-16)12-28-11-14(23)10-24-28/h7-8,10-11,13H,5-6,9,12H2,1-4H3,(H,25,29) |
| InChIKey |
JNSLPQSQYVVPMU-UHFFFAOYSA-N |
| NMR Offset |
15.328 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_UZI_26187_16595 |
| 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/1263122; Labnumber: OLG0959; UZI_ID: UZI-016599 |
| Temperature |
318 °C |
![methyl 2-[({1-[(4-bromo-1H-pyrazol-1-yl)methyl]-1H-pyrazol-3-yl}carbonyl)amino]-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate](/api/spectrum/1pakKCPBsEm/structure.png?h=300&w=458 "methyl 2-[({1-[(4-bromo-1H-pyrazol-1-yl)methyl]-1H-pyrazol-3-yl}carbonyl)amino]-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate")
