Systematic / IUPAC Name: 3-Chloro-2-{4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1H-pyrazol-1-yl}-5-(trifluoromethyl)pyridine
ID: Reference6861
Other Names: Pyridine, 3-chloro-2-{4-[(4-chlorophenyl)thio]-3,5-dimethyl-1H-pyrazol-1-yl}-5-(trifluoromethyl)-
Formula: C17H12Cl2F3N3S
3-Chloro-2-{4-[(4-chlorophenyl)thio]-3,5-dimethyl-1H-pyrazol-1-yl}-5-(trifluoromethyl)pyridine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Q Exactive Orbitrap |
No. of Spectral Trees | 1 |
No. of Spectra | 119 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | ESI |
Analyzers | FT |
Last Modification | 9/25/2017 1:17:40 PM |
InChI | InChI=1S/C17H12Cl2F3N3S/c1-9-15(26-13-5-3-12(18)4-6-13)10(2)25(24-9)16-14(19)7-11(8-23-16)17(20,21)22/h3-8H,1-2H3 |
InChI Key | IVZTTXMSHBTCTA-UHFFFAOYSA-N |
Canonical SMILES | CC1=C(C(=NN1C2=C(C=C(C=N2)C(F)(F)F)Cl)C)SC3=CC=C(C=C3)Cl |
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Other Names | Pyridine, 3-chloro-2-{4-[(4-chlorophenyl)thio]-3,5-dimethyl-1H-pyrazol-1-yl}-5-(trifluoromethyl)- |