2-(Methylthio)-5-[({2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methyl)thio]-1,3,4-thiadiazole

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Systematic / IUPAC Name: 2-(Methylsulfanyl)-5-[({2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-1,3,4-thiadiazole

ID: Reference6855

Other Names: 1,3,4-Thiadiazole, 2-(methylthio)-5-[({2-[4-(trifluoromethyl)phenyl]-4-thiazolyl}methyl)thio]- ;
2-Methylsulfanyl-5-({2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methylsulfanyl)-1,3,4-thiadiazole

Formula: C14H10F3N3S4

Spectral Data

2-(Methylthio)-5-[({2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methyl)thio]-1,3,4-thiadiazole 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 9/22/2017 11:41:57 AM
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Identificators

InChI InChI=1S/C14H10F3N3S4/c1-21-12-19-20-13(24-12)23-7-10-6-22-11(18-10)8-2-4-9(5-3-8)14(15,16)17/h2-6H,7H2,1H3
InChI Key FZEDNIPXDXEDBB-UHFFFAOYSA-N
Canonical SMILES CSC1=NN=C(S1)SCC2=CSC(=N2)C3=CC=C(C=C3)C(F)(F)F
CAS
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Other Names 1,3,4-Thiadiazole, 2-(methylthio)-5-[({2-[4-(trifluoromethyl)phenyl]-4-thiazolyl}methyl)thio]- ;
2-Methylsulfanyl-5-({2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methylsulfanyl)-1,3,4-thiadiazole

In Other Databases

ChemSpider 2025911
PubChem 2744417