SIMETRYN

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H15N5S
Molecular Weight	213.303
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCNC1=NC(SC)=NC(NCC)=N1

InChI

InChIKey=MGLWZSOBALDPEK-UHFFFAOYSA-N

InChI=1S/C8H15N5S/c1-4-9-6-11-7(10-5-2)13-8(12-6)14-3/h4-5H2,1-3H3,(H2,9,10,11,12,13)

HIDE SMILES / InChI

Molecular Formula	C8H15N5S
Molecular Weight	213.303
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Acute toxicity of rice paddy herbicides simetryn, mefenacet, and thiobencarb to Silurana tropicalis tadpoles.	2010-09	20537391
A new effect residual ratio (ERR) method for the validation of the concentration addition and independent action models.	2010-06	19949878
Mineralization of s-triazine herbicides by a newly isolated Nocardioides species strain DN36.	2010-05	20169342
Support vector regression and least squares support vector regression for hormetic dose-response curves fitting.	2010-01	19906401
Behavior of simetryn and thiobencarb in the plough zone of rice fields.	2009-12	19585064
Simulating the dissipation of two herbicides using micro paddy lysimeters.	2009-11	19811801
Improvement of extraction capability of magnetic molecularly imprinted polymer beads in aqueous media via dual-phase solvent system.	2009-08-15	19576415
Pesticides in water and sediment from littoral area of Lake Biwa.	2009-06	19277443
Pesticides in water, fish and shellfish from littoral area of Lake Biwa.	2009-06	19277442
Combined photobacterium toxicity of herbicide mixtures containing one insecticide.	2009-04	19215957
Comparison between the short-term and the long-term toxicity of six triazine herbicides on photobacteria Q67.	2009-04	19203776
Photodegradation and flow-injection determination of simetryn herbicide by luminol chemiluminescence detection.	2008-08	18689937
Molecularly imprinted polymers for triazine herbicides prepared by multi-step swelling and polymerization method. Their application to the determination of methylthiotriazine herbicides in river water.	2007-06-08	16999969
Biodegradation of methylthio-s-triazines by Rhodococcus sp. strain FJ1117YT, and production of the corresponding methylsulfinyl, methylsulfonyl and hydroxy analogues.	2007-03	17245693
Adsorption and desorption characteristics of several herbicides on sediment.	2007-01	17162561
[Simultaneous determination of triazine herbicide residues in maize by gas chromatography].	2006-11	17288154
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.	2006-11	16497524
Alternative water management for controlling simetryn and thiobencarb runoff from paddy fields.	2006-09	17033864
Effects of five rice herbicides on the growth of two threatened aquatic ferns.	2006-03	16406589
Estimation of pesticide runoff from paddy fields to rural rivers.	2006	16594332
Molecular and immunochemical characteristics of monoclonal and recombinant antibodies selective for the triazine herbicide simetryn and application to environmental analysis.	2005-06-29	15969481
Effect of natural organic matter on powdered activated carbon adsorption of trace contaminants: characteristics and mechanism of competitive adsorption.	2003-11	14511712
A DNA-electrochemical biosensor for screening environmental damage caused by s-triazine derivatives.	2002-04	12194029
Triazines in the aquatic systems of the Eastern Chinese Rivers Liao-He and Yangtse.	2002-04	11999621
Concentration and loading of pesticide residues in Lake Biwa basin (Japan).	2002-01	11766809
Algal growth inhibition by river water pollutants in the agricultural area around Lake Biwa, Japan.	2002	11911525

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:56:15 GMT 2025` Edited by `admin` on `Mon Mar 31 18:56:15 GMT 2025`
Record UNII	036180247V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GY-BON

Preferred Name

English

SIMETRYN

Common Name

English

G-32911

Code

English

N(SUP 2),N(SUP 4)-DIETHYL-6-METHYLTHIO-1,3,5-TRIAZINE-2,4-DIAMINE

Systematic Name

English

2,4-BIS(ETHYLAMINO)-6-(METHYLTHIO)-S-TRIAZINE

Systematic Name

English

SIMETRYN [MI]

Common Name

English

NSC-163051

Code

English

N,N'-DIETHYL-6-(METHYLTHIO)-1,3,5-TRIAZINE-2,4-DIAMINE

Systematic Name

English

SIMETRYN [ISO]

Common Name

English

Code System Code Type Description

MESH

C033807