Sotalol

Synonyms: sotalol, "Sotalolum", "beta-Cardone", "MJ-1999", "N-(4-(1-Hydroxy-2-(isopropylamino)ethyl)phenyl)methanesulfonamide", ".beta.-Cardone", "Sorine", "CCRIS 4204", "4'-(1-Hydroxy-2-(isopropylamino)ethyl)methane sulfonanilide", "CHEMBL471", "4'-(1-Hydroxy-2-isopropylaminoethyl)methanesulfonanilid", "Methanesulfonanilide, 4'-(1-hydroxy-2-(isopropylamino)ethyl)-", "N-{4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl}methanesulfonamide".

Source: Sotalol is a commonly used antiarrhythmic drug.

Identifiers:

IUPAC Name: N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide
CAS Number: 3930-20-9
PubChem ID: 5253
InChiKey: ZBMZVLHSJCTVON-UHFFFAOYSA-N
Canonical SMILES: CC(C)NCC(C1=CC=C(C=C1)NS(=O)(=O)C)O

Structural Properties:

Molecular Formula: C₁₂H₂₀N₂O₃S
Molecular Weight: 272.37

Pharmacophore Features:

Number of bond donors: 3
Number of bond acceptors: 5
Number of atoms different from hydrogen: 18

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Evidence Supporting This Chemical as an Emerging Contaminant

Hermes, N., Jewell, K., Wick, A., & Ternes, T. (2018). Quantification of more than 150 micropollutants including transformation products in aqueous samples by liquid chromatography-tandem mass spectrometry using scheduled multiple reaction monitoring. Journal of Chromatography A, 1531, 64?73.

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