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Sulfadimethoxine-[13C6]

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Sulfadimethoxine-[13C6]

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General Information
Catalog: BLP-013131
CAS: 1334378-48-1
Molecular Formula: C6[13C]6H14N4O4S
Molecular Weight: 316.29

Chemical Structure

Description	An isotope labelled Sulfadimethoxine. Sulfadimethoxine is a sulfonamide antimicrobial medication used in veterinary medicine.
Synonyms	4-Amino-N-[2,6-dimethoxypyrimidin-4-yl]-benzene-13C6-sulfonamide
IUPAC Name	4-amino-N-(2,6-dimethoxypyrimidin-4-yl)(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene-1-sulfonamide
Related CAS	122-11-2 (unlabelled)
Isomeric SMILES	COC1=NC(=NC(=C1)NS(=O)(=O)[13C]2=[13CH][13CH]=[13C]([13CH]=[13CH]2)N)OC
Canonical SMILES	COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)N)OC
InChI	InChI=1S/C12H14N4O4S/c1-19-11-7-10(14-12(15-11)20-2)16-21(17,18)9-5-3-8(13)4-6-9/h3-7H,13H2,1-2H3,(H,14,15,16)/i3+1,4+1,5+1,6+1,8+1,9+1
InChI Key	ZZORFUFYDOWNEF-CICUYXHZSA-N
Purity	95% by HPLC; 98% atom 13C
Density	1.4±0.1 g/cm3