| SpectraBase Spectrum ID |
12qaN6RYaO |
| Name |
2-mercapto-1-(2-(5-(p-tolyl)imidazol-2-yl)piperidin-1-yl)propan-1-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H23N3OS |
| InChI |
InChI=1S/C18H23N3OS/c1-12-6-8-14(9-7-12)15-11-19-17(20-15)16-5-3-4-10-21(16)18(22)13(2)23/h6-9,11,13,16,23H,3-5,10H2,1-2H3,(H,19,20) |
| InChIKey |
LCMBHJPZYJCYFI-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Molecular Weight |
329.462 g/mol |
| SMILES |
SC(C(N1C(c2ncc([nH]2)-c2ccc(cc2)C)CCCC1)=O)C |
| SPLASH |
splash10-03dl-9080000000-52c2d87e5caf2f62d89a |
| Source of Spectrum |
WO2021074281A1 |
| Wiley ID |
1880106 |
