Hexythiazox

Synonyms: Hexythiazox, "Savey", "Nissorun", "Calibre", "Ordoval", "Matacar", "Acariflor", "Acarflor", "Cesar", "Trevi", "Zeldox (acaricide)", "(S,S)-hexythiazox", "(4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide", "(4RS,5RS)-5-(4-Chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide"

Source: Hexythiazox is a thiazolidine acaricide

Identifiers:

IUPAC Name: (4S,5S)-5-(4-chlorophenyl)-N-cyclohexyl-4-methyl-2-oxo-1,3-thiazolidine-3-carboxamide
CAS Number: 78587-05-0
PubChem ID: 13218777
InChiKey: XGWIJUOSCAQSSV-XHDPSFHLSA-N
Canonical SMILES: CC1C(SC(=O)N1C(=O)NC2CCCCC2)C3=CC=C(C=C3)Cl

Structural Properties:

Molecular Formula: C₁₇H₂₁ClN₂O₂S
Molecular Weight: 352,900

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 3
Number of atoms different from hydrogen: 23

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Evidence Supporting This Chemical as an Emerging Contaminant

Banjac, Z., Ginebreda, A., Kuzmanovic, M., Marc?, R., Nadal, M., Riera, J. M., & Barcel?, D. (2015). Emission factor estimation of ca. 160 emerging organic microcontaminants by inverse modeling in a Mediterranean river basin (Llobregat, NE Spain). Science of the Total Environment, 520, 241-252.

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