N-(4,6-Dimethyl-2-pyrimidinyl)-4-({[2-(trifluoromethyl)anilino]carbonyl}amino)benzenesulfonamide

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Systematic / IUPAC Name: N-(4,6-Dimethyl-2-pyrimidinyl)-4-({[2-(trifluoromethyl)phenyl]carbamoyl}amino)benzenesulfonamide

ID: Reference3795

Other Names: 1-{4-[(4,6-Dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-3-[2-(trifluoromethyl)phenyl]urea;
Benzenesulfonamide, N-(4,6-dimethyl-2-pyrimidinyl)-4-[({[2-(trifluoromethyl)phenyl]amino}carbonyl)amino]-

Formula: C20H18F3N5O3S

Spectral Data

N-(4,6-Dimethyl-2-pyrimidinyl)-4-({[2-(trifluoromethyl)anilino]carbonyl}amino)benzenesulfonamide 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 237
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/11/2016 10:21:19 AM
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Identificators

InChI InChI=1S/C20H18F3N5O3S/c1-12-11-13(2)25-18(24-12)28-32(30,31)15-9-7-14(8-10-15)26-19(29)27-17-6-4-3-5-16(17)20(21,22)23/h3-11H,1-2H3,(H,24,25,28)(H2,26,27,29)
InChI Key ASMNIDORQILGQG-UHFFFAOYSA-N
Canonical SMILES CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3C(F)(F)F)C
CAS
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Other Names 1-{4-[(4,6-Dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-3-[2-(trifluoromethyl)phenyl]urea;
Benzenesulfonamide, N-(4,6-dimethyl-2-pyrimidinyl)-4-[({[2-(trifluoromethyl)phenyl]amino}carbonyl)amino]-

In Other Databases

PubChem 2813525
ChemSpider 2091926