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Sulfamerazine-[13C6]

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General Information
Catalog: BLP-011695
CAS: 1196157-80-8
Molecular Formula: C5[13C]6H12N4O2S
Molecular Weight: 270.26

Chemical Structure

Description	Sulfamerazine-[13C6] is the labelled analogue of Sulfadiazine, which is a sulfonamides antibacterial drug.
Synonyms	Sulfamerazine-13C6; 4-Amino-N-(4-methylpyrimidin-2-yl)-benzene-13C6-sulfonamide; 4-Amino-N-(4-methylpyrimidin-2-yl)benzenesulfonamide-13C6; 4-Amino-N-(4-methyl-2-pyrimidinyl)-benzene-1,2,3,4,5,6-13C6-sulfonamide; Sulfamerazine-(phenyl-13C6)
IUPAC Name	4-amino-N-(4-methylpyrimidin-2-yl)(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene-1-sulfonamide
Related CAS	127-79-7 (unlabelled) 127-58-2 (unlabelled sodium)
Isomeric SMILES	CC1=NC(=NC=C1)NS(=O)(=O)[13C]2=[13CH][13CH]=[13C]([13CH]=[13CH]2)N
Canonical SMILES	CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)N
InChI	InChI=1S/C11H12N4O2S/c1-8-6-7-13-11(14-8)15-18(16,17)10-4-2-9(12)3-5-10/h2-7H,12H2,1H3,(H,13,14,15)/i2+1,3+1,4+1,5+1,9+1,10+1
InChI Key	QPPBRPIAZZHUNT-PBZDKDNVSA-N
Purity	95% by HPLC; 98% atom 13C
Solubility	Soluble in DMSO (Slightly), Methanol (Slightly)
Appearance	White Solid
Storage	Store at 2-8°C