N1-{4-[(4-Chlorophenyl)sulfonyl]-3-(methylthio)-1H-pyrazol-5-yl}-2-chlorobenzamide

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Systematic / IUPAC Name: 2-Chloro-N-{4-[(4-chlorophenyl)sulfonyl]-3-(methylsulfanyl)-1H-pyrazol-5-yl}benzamide

ID: Reference4358

Other Names: Benzamide, 2-chloro-N-{4-[(4-chlorophenyl)sulfonyl]-3-(methylthio)-1H-pyrazol-5-yl}-

Formula: C17H13Cl2N3O3S2

Spectral Data

N1-{4-[(4-Chlorophenyl)sulfonyl]-3-(methylthio)-1H-pyrazol-5-yl}-2-chlorobenzamide 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 93
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/24/2016 11:33:58 AM
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Identificators

InChI InChI=1S/C17H13Cl2N3O3S2/c1-26-17-14(27(24,25)11-8-6-10(18)7-9-11)15(21-22-17)20-16(23)12-4-2-3-5-13(12)19/h2-9H,1H3,(H2,20,21,22,23)
InChI Key NDXYFINSNFDXLJ-UHFFFAOYSA-N
Canonical SMILES CSC1=NNC(=C1S(=O)(=O)C2=CC=C(C=C2)Cl)NC(=O)C3=CC=CC=C3Cl
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Other Names Benzamide, 2-chloro-N-{4-[(4-chlorophenyl)sulfonyl]-3-(methylthio)-1H-pyrazol-5-yl}-

In Other Databases

PubChem 2819268
ChemSpider 2097502