| SpectraBase Spectrum ID |
HxacJP6C7BG |
| Name |
2-p-nitrobenzylthio-5-piperidinomethyl-6-methyluracil |
| Alternate Name(s) |
6-Methyl-2-((4-nitrobenzyl)thio)-5-(piperidin-1-ylmethyl)pyrimidin-4(3H)-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H22N4O3S |
| InChI |
InChI=1S/C18H22N4O3S/c1-13-16(11-21-9-3-2-4-10-21)17(23)20-18(19-13)26-12-14-5-7-15(8-6-14)22(24)25/h5-8H,2-4,9-12H2,1H3,(H,19,20,23) |
| InChIKey |
YKKYMPGUHCHMGQ-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1002/rcm.2338 |
| Molecular Weight |
374.459 g/mol |
| SMILES |
N1C(=NC(=C(C1=O)CN1CCCCC1)C)SCc1ccc(cc1)[N+]([O-])=O |
| SPLASH |
splash10-001j-9110000000-32d5d8f2640ece876f3c |
| Source of Spectrum |
RCM-20-714-11 |
| Wiley ID |
1820524 |
