| SpectraBase Spectrum ID |
9fImmH3Y7oN |
| Name |
ethyl 4-{4-[2-(4-bromoanilino)-2-oxoethyl]-3-[3-(4-ethyl-1-piperazinyl)propyl]-5-oxo-2-thioxo-1-imidazolidinyl}benzoate |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
629.167138829 u |
| Formula |
C29H36BrN5O4S |
| InChI |
InChI=1S/C29H36BrN5O4S/c1-3-32-16-18-33(19-17-32)14-5-15-34-25(20-26(36)31-23-10-8-22(30)9-11-23)27(37)35(29(34)40)24-12-6-21(7-13-24)28(38)39-4-2/h6-13,25H,3-5,14-20H2,1-2H3,(H,31,36) |
| InChIKey |
NTAQMIOTFUKDBI-UHFFFAOYSA-N |
| Molecular Weight |
630.602 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_8578 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13219862 |
![ethyl 4-{4-[2-(4-bromoanilino)-2-oxoethyl]-3-[3-(4-ethyl-1-piperazinyl)propyl]-5-oxo-2-thioxo-1-imidazolidinyl}benzoate](/api/spectrum/9fImmH3Y7oN/structure.png?h=300&w=458 "ethyl 4-{4-[2-(4-bromoanilino)-2-oxoethyl]-3-[3-(4-ethyl-1-piperazinyl)propyl]-5-oxo-2-thioxo-1-imidazolidinyl}benzoate")
