N4-[3,5-Bis(trifluoromethyl)phenyl]-3,5-bis(methylthio)isothiazole-4-carboxamide

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Systematic / IUPAC Name: N-[3,5-Bis(trifluoromethyl)phenyl]-3,5-bis(methylsulfanyl)-1,2-thiazole-4-carboxamide

ID: Reference4152

Other Names:

Formula: C14H10F6N2OS3

Spectral Data

N4-[3,5-Bis(trifluoromethyl)phenyl]-3,5-bis(methylthio)isothiazole-4-carboxamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

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 3/10/2016 2:28:40 PM
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Identificators

InChI InChI=1S/C14H10F6N2OS3/c1-24-11-9(12(25-2)26-22-11)10(23)21-8-4-6(13(15,16)17)3-7(5-8)14(18,19)20/h3-5H,1-2H3,(H,21,23)
InChI Key LYZFMCMNGXDWIF-UHFFFAOYSA-N
Canonical SMILES CSC1=C(C(=NS1)SC)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F
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In Other Databases

PubChem 2739021
ChemSpider 2020646