| SpectraBase Spectrum ID |
3k3sXdvPL0a |
| Name |
benzeneacetamide, N-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-4-(1,4-dihydro-2,4-dioxothieno[3,2-d]pyrimidin-3(2H)-yl)- |
| Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
537.160138653 u |
| Formula |
C27H28ClN5O3S |
| InChI |
InChI=1S/C27H28ClN5O3S/c28-20-3-1-4-22(18-20)32-14-12-31(13-15-32)11-2-10-29-24(34)17-19-5-7-21(8-6-19)33-26(35)25-23(9-16-37-25)30-27(33)36/h1,3-9,16,18H,2,10-15,17H2,(H,29,34)(H,30,36) |
| InChIKey |
MDNQTFHGWUHILK-UHFFFAOYSA-N |
| Molecular Weight |
538.066 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_5579 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13288976 |