| SpectraBase Spectrum ID |
1oZX13DWxjD |
| Name |
3-Cyano-5-amino-4-[(4-carboxyphenyl)thio]-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]pyrazole |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H9Cl2F3N4O2S |
| InChI |
InChI=1S/C18H9Cl2F3N4O2S/c19-11-5-9(18(21,22)23)6-12(20)14(11)27-16(25)15(13(7-24)26-27)30-10-3-1-8(2-4-10)17(28)29/h1-6H,25H2,(H,28,29) |
| InChIKey |
FYCZJMLSYHGUNZ-UHFFFAOYSA-N |
| Molecular Weight |
473.257 g/mol |
| SMILES |
OC(c1ccc(Sc2c(n[n](c2N)-c2c(cc(C(F)(F)F)cc2Cl)Cl)C#N)cc1)=O |
| SPLASH |
splash10-00di-0000900000-3646f8f373eba76c6393 |
| Source of Spectrum |
F4-41-926-16 |
| Wiley ID |
1672225 |
![3-Cyano-5-amino-4-[(4-carboxyphenyl)thio]-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]pyrazole](/api/spectrum/1oZX13DWxjD/structure.png?h=300&w=458 "3-Cyano-5-amino-4-[(4-carboxyphenyl)thio]-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]pyrazole")
