prometryn

Synonyms: "prometryne", "prometryn", "gesagard", "prometrex", "caparol", "uvon", "primatol Q", "mercasin", "mercazin", "merkazin"

Source: prometryn is a soil-applied herbicide used in cotton production.

Identifiers:

IUPAC Name: 6-methylsulfanyl-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine
CAS Number: 7287-19-6
PubChem ID: 4929
InChiKey: AAEVYOVXGOFMJO-UHFFFAOYSA-N
Canonical SMILES: CC(C)NC1=NC(=NC(=N1)SC)NC(C)C

Structural Properties:

Molecular Formula: C₁₀H₁₉N₅S
Molecular Weight: 241.356

Pharmacophore Features:

Number of bond donors: 2
Number of bond acceptors: 5
Number of atoms different from hydrogen: 16

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2D structure (.sdf)
3D structure (.sdf)
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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors

Ghinea E, Simionescu L, Oprescu M. 1980. Studies on the action of pesticides upon the endocrines using in vitro human thyroid cell culture and in vivo animal models. II. Herbicides - prometrin and terbutrin. Rev. Roum. Med. - Endocrinology 18(3):167-173.

Kniewald J, Osredecki V, Gojmerac T, Zechner V, Kniewald Z. 1995. Effect of s-triazine compounds on testosterone metabolism in the rat prostate. J Appl Toxicol 15(3):215-218.