N-{6-[(4-Methylphenyl)thio]-3-pyridyl}-N'-[4-(trifluoromethoxy)phenyl]urea

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Systematic / IUPAC Name: 1-{6-[(4-Methylphenyl)sulfanyl]-3-pyridinyl}-3-[4-(trifluoromethoxy)phenyl]urea

ID: Reference4304

Other Names: N-{6-[(4-Methylphenyl)thio]-3-pyridyl}-N'-[4-(trifluoromethoxy)phenyl]urea ;
Urea, N-{6-[(4-methylphenyl)thio]-3-pyridinyl}-N'-[4-(trifluoromethoxy)phenyl]-

Formula: C20H16F3N3O2S

Spectral Data

N-{6-[(4-Methylphenyl)thio]-3-pyridyl}-N'-[4-(trifluoromethoxy)phenyl]urea 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 2
No. of Spectra 234
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/21/2016 9:54:20 AM
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Identificators

InChI InChI=1S/C20H16F3N3O2S/c1-13-2-9-17(10-3-13)29-18-11-6-15(12-24-18)26-19(27)25-14-4-7-16(8-5-14)28-20(21,22)23/h2-12H,1H3,(H2,25,26,27)
InChI Key OOOKYCQMTWMZQY-UHFFFAOYSA-N
Canonical SMILES CC1=CC=C(C=C1)SC2=NC=C(C=C2)NC(=O)NC3=CC=C(C=C3)OC(F)(F)F
CAS
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Other Names N-{6-[(4-Methylphenyl)thio]-3-pyridyl}-N'-[4-(trifluoromethoxy)phenyl]urea ;
Urea, N-{6-[(4-methylphenyl)thio]-3-pyridinyl}-N'-[4-(trifluoromethoxy)phenyl]-

In Other Databases

PubChem 2800852
ChemSpider 2079574