N1-[3-(Methylthio)phenyl]-2-(3,5-dimethyl-4-phenoxy-1H-pyrazol-1-yl)acetamide

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Systematic / IUPAC Name: 2-(3,5-Dimethyl-4-phenoxy-1H-pyrazol-1-yl)-N-[3-(methylsulfanyl)phenyl]acetamide

ID: Reference4632

Other Names: 1H-Pyrazole-1-acetamide, 3,5-dimethyl-N-[3-(methylthio)phenyl]-4-phenoxy-

Formula: C20H21N3O2S

Spectral Data

N1-[3-(Methylthio)phenyl]-2-(3,5-dimethyl-4-phenoxy-1H-pyrazol-1-yl)acetamide 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 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 4/25/2016 1:10:52 PM
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Identificators

InChI InChI=1S/C20H21N3O2S/c1-14-20(25-17-9-5-4-6-10-17)15(2)23(22-14)13-19(24)21-16-8-7-11-18(12-16)26-3/h4-12H,13H2,1-3H3,(H,21,24)
InChI Key MZVLQZQRQCDSSV-UHFFFAOYSA-N
Canonical SMILES CC1=C(C(=NN1CC(=O)NC2=CC(=CC=C2)SC)C)OC3=CC=CC=C3
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Other Names 1H-Pyrazole-1-acetamide, 3,5-dimethyl-N-[3-(methylthio)phenyl]-4-phenoxy-

In Other Databases

PubChem 2746418
ChemSpider 2027892