SpectraBase Spectrum ID |
2MXhOnhVhY |
Name |
Ethyl 5-(benzylthio)-3-methyl-1-tosyl-1H-pyrazole-4-carboxylate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H22N2O4S2 |
InChI |
InChI=1S/C21H22N2O4S2/c1-4-27-21(24)19-16(3)22-23(20(19)28-14-17-8-6-5-7-9-17)29(25,26)18-12-10-15(2)11-13-18/h5-13H,4,14H2,1-3H3 |
InChIKey |
BMAPJHPVQZVLKN-UHFFFAOYSA-N |
Literature Reference DOI |
10.1002/cjoc.20010190213 |
Molecular Weight |
430.537 g/mol |
SMILES |
c1(n[n](S(=O)(c2ccc(cc2)C)=O)c(c1C(OCC)=O)SCc1ccccc1)C |
SPLASH |
splash10-000l-7920000000-9e3623c3a191e2b55d73 |
Source of Spectrum |
CJC-19-187-9b |
Wiley ID |
1774747 |