Sulfaguanidine

Synonyms: sulfaguanidine, "Sulphaguanidine", "Sulfaguanidin", "Sulfaguine", "Guanicil", "Sulfanilguanidine", "Sulfoguanidine", "Sulfanilylguanidine", "Sulfentidine", "Guanidan", "Abiguanil", "Sulfoguanyl", "Sulfoguanil", "Sulfaguanil", "Guamide", "Aterian", "Sulfoquanidine", "Orgaguanidon", "Resulfon", "Ganidan", "Suganyl", "N1-Amidinosulfanilamide", "Sulgin", "Ruocid", "Diacta", "N-Guanylsulfanilamide", "S-Guanidine", "1-Sulfanilylguanidine", "Sulfaguanidinum", "Sulfoguenil", "Shigatox", "Guanidine, sulfanilyl-", "p-Aminobenzenesulfonylguanidine", "Solfaguanidina", "Sulfaguanidina", "Sulginum"

Source: Sulfaguanidine is an antimicrobial substance used to treat intestinal infections.

Identifiers:

IUPAC Name: 2-(4-aminophenyl)sulfonylguanidine
CAS Number: 57-67-0
PubChem ID: 5324
InChiKey: BRBKOPJOKNSWSG-UHFFFAOYSA-N
Canonical SMILES: C1=CC(=CC=C1N)S(=O)(=O)N=C(N)N

Structural Properties:

Molecular Formula: C₇H₁₀N₄O₂S
Molecular Weight: 214,250

Pharmacophore Features:

Number of bond donors: 3
Number of bond acceptors: 4
Number of atoms different from hydrogen: 14

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Evidence Supporting This Chemical as an Emerging Contaminant

Lai, W. W. P., Lin, Y. C., Wang, Y. H., Guo, Y. L., & Lin, A. Y. C. (2018). Occurrence of emerging contaminants in aquaculture waters: cross-contamination between aquaculture systems and surrounding waters. Water, Air, & Soil Pollution, 229(8), 249.

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2D-structure

3D-structure