| SpectraBase Spectrum ID |
L33ifpEkMVC |
| Name |
2-m-nitrobenzylthio-5-piperidinomethyl-6-methyluracil |
| Alternate Name(s) |
6-Methyl-2-((3-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(11-21-8-3-2-4-9-21)17(23)20-18(19-13)26-12-14-6-5-7-15(10-14)22(24)25/h5-7,10H,2-4,8-9,11-12H2,1H3,(H,19,20,23) |
| InChIKey |
XWAPILSWMYBQGG-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1002/rcm.2338 |
| Molecular Weight |
374.459 g/mol |
| SMILES |
N1C(=NC(=C(C1=O)CN1CCCCC1)C)SCc1cc(ccc1)[N+](=O)[O-] |
| SPLASH |
splash10-001a-9400000000-7dd017d31a3752bf2f7f |
| Source of Spectrum |
RCM-20-714-7 |
| Wiley ID |
1820544 |
