SpectraBase Spectrum ID |
Itd5Xa8y6tm |
Name |
methyl 2-({4-[(4-chloro-1H-pyrazol-1-yl)methyl]benzoyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-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/C20H18ClN3O3S/c1-27-20(26)17-15-3-2-4-16(15)28-19(17)23-18(25)13-7-5-12(6-8-13)10-24-11-14(21)9-22-24/h5-9,11H,2-4,10H2,1H3,(H,23,25) |
InChIKey |
YMKZPDMXGXATIT-UHFFFAOYSA-N |
NMR Offset |
15.3537 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_UBI_21270_4222 |
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: 9679330; UBI_ID: UBI-004223 |
Temperature |
308 °C |