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N-Acetyl Sulfadiazine-[13C6]

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General Information
Catalog: BLP-004877
CAS: 1217089-17-2
Molecular Formula: C6[13C]6H12N4O3S
Molecular Weight: 298.27

Chemical Structure

Description	N-Acetyl Sulfadiazine-[13C6] is the labelled analogue of N-Acetyl sulfadiazine. N-Acetyl sulfadiazine is a metabolite of sulfadiazine, an antibiotic used for the treatment of bacterial infections.
Synonyms	N-Acetyl Sulfadiazine-13C6; N-[4-[(2-Pyrimidinylamino)sulfonyl]phenyl-13C6]acetamide; 2-[(p-Acetamidophenyl-13C6)sulfonamido]pyrimidine; N4-Acetylsulfadiazine-13C6; 4'-(2-Pyrimidinylsulfamoyl)acetanilide-13C6; 4N-Acetylsulfadiazine-13C6
IUPAC Name	N-[4-(pyrimidin-2-ylsulfamoyl)(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl]acetamide
Related CAS	127-74-2 (unlabelled)
Canonical SMILES	CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2
InChI	InChI=1S/C12H12N4O3S/c1-9(17)15-10-3-5-11(6-4-10)20(18,19)16-12-13-7-2-8-14-12/h2-8H,1H3,(H,15,17)(H,13,14,16)/i3+1,4+1,5+1,6+1,10+1,11+1
InChI Key	NJIZUWGMNCUKGU-BULCFLCISA-N
Melting Point	248-253°C
Purity	98%; ≥99% atom 13C
Solubility	Slightly soluble in DMSO, Methanol
Appearance	Off-white Solid
Storage	Store at -20°C