| SpectraBase Spectrum ID |
I2XghvwrKk6 |
| Name |
benzoic acid, 4-[[[[6-[[2-(1-pyrrolidinylcarbonyl)benzoyl]amino]-2-benzothiazolyl]thio]acetyl]amino]-, methyl ester |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
574.134462296 u |
| Formula |
C29H26N4O5S2 |
| InChI |
InChI=1S/C29H26N4O5S2/c1-38-28(37)18-8-10-19(11-9-18)30-25(34)17-39-29-32-23-13-12-20(16-24(23)40-29)31-26(35)21-6-2-3-7-22(21)27(36)33-14-4-5-15-33/h2-3,6-13,16H,4-5,14-15,17H2,1H3,(H,30,34)(H,31,35) |
| InChIKey |
LCCBJNVAQJPPFC-UHFFFAOYSA-N |
| Molecular Weight |
574.670 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_9912 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9244569; Lab Info: LP; Lab Number: LP-0609072 |
![benzoic acid, 4-[[[[6-[[2-(1-pyrrolidinylcarbonyl)benzoyl]amino]-2-benzothiazolyl]thio]acetyl]amino]-, methyl ester](/api/spectrum/I2XghvwrKk6/structure.png?h=300&w=458 "benzoic acid, 4-[[[[6-[[2-(1-pyrrolidinylcarbonyl)benzoyl]amino]-2-benzothiazolyl]thio]acetyl]amino]-, methyl ester")
