N-(3-Phenoxy-4-pyridinio)methane-sulfonamidate

Catherine Michaux; Caroline Charlier; Fabien Julémont; Jean-Michel Dogné; Xavier de Leval; Bernadette Norberg; Bernard Pirotte; François Durant

N-(3-Phenoxy-4-pyridinio)methane-sulfonamidate

Catherine Michaux, Caroline Charlier, Fabien Julémont, Jean-Michel Dogné, Xavier de Leval, Bernadette Norberg, Bernard Pirotte, François Durant

Research output: Contribution to journal › Article › peer-review

Abstract

The title compound, C(12)H(12)N(2)O(3)S, is a strict pyridine analogue of nimesulide, a selective inhibitor of cyclooxygenase-2. The structure is characterized by a pyridinium ring with a deprotonated sulfonamide group. An intermolecular charge-assisted hydrogen bond between these two groups is observed within the crystal packing, linking the molecules into an infinite chain running along the b-axis direction.

Original language	English
Pages (from-to)	88-89
Number of pages	2
Journal	Acta crystallographica. Section C: Crystal structure communications
Volume	58
Issue number	Pt 2
Publication status	Published - Feb 2002

Keywords

Aminopyridines
Crystallography, X-Ray
Cyclooxygenase 2
Cyclooxygenase 2 Inhibitors
Cyclooxygenase Inhibitors
Hydrogen Bonding
Isoenzymes
Models, Molecular
Prostaglandin-Endoperoxide Synthases
Sulfonamides

Cite this

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title = "N-(3-Phenoxy-4-pyridinio)methane-sulfonamidate",

abstract = "The title compound, C(12)H(12)N(2)O(3)S, is a strict pyridine analogue of nimesulide, a selective inhibitor of cyclooxygenase-2. The structure is characterized by a pyridinium ring with a deprotonated sulfonamide group. An intermolecular charge-assisted hydrogen bond between these two groups is observed within the crystal packing, linking the molecules into an infinite chain running along the b-axis direction.",

keywords = "Aminopyridines, Crystallography, X-Ray, Cyclooxygenase 2, Cyclooxygenase 2 Inhibitors, Cyclooxygenase Inhibitors, Hydrogen Bonding, Isoenzymes, Models, Molecular, Prostaglandin-Endoperoxide Synthases, Sulfonamides",

author = "Catherine Michaux and Caroline Charlier and Fabien Jul{\'e}mont and Jean-Michel Dogn{\'e} and {de Leval}, Xavier and Bernadette Norberg and Bernard Pirotte and Fran{\c c}ois Durant",

note = "Publication code : **RES. ACAD.",

year = "2002",

month = feb,

language = "English",

volume = "58",

pages = "88--89",

journal = "Acta crystallographica. Section C: Crystal structure communications",

issn = "0108-2701",

publisher = "Munksgaard",

number = "Pt 2",

}

TY - JOUR

T1 - N-(3-Phenoxy-4-pyridinio)methane-sulfonamidate

AU - Michaux, Catherine

AU - Charlier, Caroline

AU - Julémont, Fabien

AU - Dogné, Jean-Michel

AU - de Leval, Xavier

AU - Norberg, Bernadette

AU - Pirotte, Bernard

AU - Durant, François

N1 - Publication code : **RES. ACAD.

PY - 2002/2

Y1 - 2002/2

N2 - The title compound, C(12)H(12)N(2)O(3)S, is a strict pyridine analogue of nimesulide, a selective inhibitor of cyclooxygenase-2. The structure is characterized by a pyridinium ring with a deprotonated sulfonamide group. An intermolecular charge-assisted hydrogen bond between these two groups is observed within the crystal packing, linking the molecules into an infinite chain running along the b-axis direction.

AB - The title compound, C(12)H(12)N(2)O(3)S, is a strict pyridine analogue of nimesulide, a selective inhibitor of cyclooxygenase-2. The structure is characterized by a pyridinium ring with a deprotonated sulfonamide group. An intermolecular charge-assisted hydrogen bond between these two groups is observed within the crystal packing, linking the molecules into an infinite chain running along the b-axis direction.

KW - Aminopyridines

KW - Crystallography, X-Ray

KW - Cyclooxygenase 2

KW - Cyclooxygenase 2 Inhibitors

KW - Cyclooxygenase Inhibitors

KW - Hydrogen Bonding

KW - Isoenzymes

KW - Models, Molecular

KW - Prostaglandin-Endoperoxide Synthases

KW - Sulfonamides

M3 - Article

C2 - 11828118

SN - 0108-2701

VL - 58

SP - 88

EP - 89

JO - Acta crystallographica. Section C: Crystal structure communications

JF - Acta crystallographica. Section C: Crystal structure communications

IS - Pt 2

ER -

N-(3-Phenoxy-4-pyridinio)methane-sulfonamidate

Abstract

Keywords

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