N-{4-Methyl-3-[(methylsulfonyl)amino]phenyl}-3-thiophenecarboxamide

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Systematic / IUPAC Name: N-{4-Methyl-3-[(methylsulfonyl)amino]phenyl}-3-thiophenecarboxamide

ID: Reference5669

Other Names: N-(3-Methanesulfonamido-4-methylphenyl)thiophene-3-carboxamide;
3-Thiophenecarboxamide, N-{4-methyl-3-[(methylsulfonyl)amino]phenyl}-

Formula: C13H14N2O3S2

Class: Endogenous Metabolites Excipients/Additives/Colorants Personal Care Products/Cosmetics Industrial Chemicals

Spectral Data

N-{4-Methyl-3-[(methylsulfonyl)amino]phenyl}-3-thiophenecarboxamide 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 4/18/2017 8:26:31 AM
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Identificators

InChI InChI=1S/C13H14N2O3S2/c1-9-3-4-11(7-12(9)15-20(2,17)18)14-13(16)10-5-6-19-8-10/h3-8,15H,1-2H3,(H,14,16)
InChI Key XOXKVNBJMGTXCY-UHFFFAOYSA-N
Canonical SMILES CC1=C(C=C(C=C1)NC(=O)C2=CSC=C2)NS(=O)(=O)C
CAS
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Other Names N-(3-Methanesulfonamido-4-methylphenyl)thiophene-3-carboxamide;
3-Thiophenecarboxamide, N-{4-methyl-3-[(methylsulfonyl)amino]phenyl}-

In Other Databases

PubChem 2811612
ChemSpider 2090022
ChEMBL CHEMBL1597382