SpectraBase Spectrum ID |
6Dlvim83hFy |
Name |
3-(p-Methylphenyl)-4-[5'-amino-4'-(p-methylphenylsulfonyl)isoxazol-3'-yl]sydnone |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H16N4O5S |
InChI |
InChI=1S/C19H16N4O5S/c1-11-3-7-13(8-4-11)23-16(19(24)28-22-23)15-17(18(20)27-21-15)29(25,26)14-9-5-12(2)6-10-14/h3-10H,1-2H3,(H2-,20,21,22,24) |
InChIKey |
RHQILQXEMAWKLR-UHFFFAOYSA-N |
Molecular Weight |
412.420 g/mol |
SMILES |
Nc1c(c(-c2[n+](noc2[O-])-c2ccc(cc2)C)no1)S(c1ccc(cc1)C)(=O)=O |
SPLASH |
splash10-0f6x-9006000000-3ce30ac71931089119f0 |
Source of Spectrum |
QA-39-166-4 |
Synonyms |
4-{5-amino-4-[(4-methylphenyl)sulfonyl]-3-isoxazolyl}-3-(4-methylphenyl)-1,2,3-oxadiazol-3-ium-5-olate |
Wiley ID |
861433 |