SpectraBase Spectrum ID |
IUu23a5yOSM |
Name |
benzamide, N-[2-[[2-[(2,3-dimethylphenyl)amino]-2-oxoethyl]thio]-6-benzothiazolyl]-2-(1-pyrrolidinylcarbonyl)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
544.160283123 u |
Formula |
C29H28N4O3S2 |
InChI |
InChI=1S/C29H28N4O3S2/c1-18-8-7-11-23(19(18)2)31-26(34)17-37-29-32-24-13-12-20(16-25(24)38-29)30-27(35)21-9-3-4-10-22(21)28(36)33-14-5-6-15-33/h3-4,7-13,16H,5-6,14-15,17H2,1-2H3,(H,30,35)(H,31,34) |
InChIKey |
RADROYIAZMZMBQ-UHFFFAOYSA-N |
Molecular Weight |
544.688 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_9913 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9244572; Lab Info: LP; Lab Number: LP-0609075 |