SpectraBase Spectrum ID |
KGqPcotAJha |
Name |
ethyl 4-[4-[2-(4-chloroanilino)-2-oxoethyl]-3-(3,4-dimethoxybenzyl)-5-oxo-2-thioxo-1-imidazolidinyl]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/C29H28ClN3O6S/c1-4-39-28(36)19-6-12-22(13-7-19)33-27(35)23(16-26(34)31-21-10-8-20(30)9-11-21)32(29(33)40)17-18-5-14-24(37-2)25(15-18)38-3/h5-15,23H,4,16-17H2,1-3H3,(H,31,34) |
InChIKey |
XMQCPTXWPYFWBP-UHFFFAOYSA-N |
NMR Offset |
15.328 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_2284 |
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: D02360; Labnumber: MPOL-10730; SBI_ID: SBI-002286 |
Temperature |
318 °C |