SpectraBase Spectrum ID |
KsZq8msJDVn |
Name |
acetamide, 2-[[7-[(2-chlorophenyl)methyl]-2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-8-yl]thio]-N-(2-phenylethyl)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
497.128838524 u |
Formula |
C24H24ClN5O3S |
InChI |
InChI=1S/C24H24ClN5O3S/c1-28-21-20(22(32)29(2)24(28)33)30(14-17-10-6-7-11-18(17)25)23(27-21)34-15-19(31)26-13-12-16-8-4-3-5-9-16/h3-11H,12-15H2,1-2H3,(H,26,31) |
InChIKey |
HHBRTAUGKMIQRQ-UHFFFAOYSA-N |
Molecular Weight |
498.001 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_17768 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/11210032; Lab Info: SAD; Lab Number: 4 |