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Details

Stereochemistry ACHIRAL
Molecular Formula C16H22N4O3S
Molecular Weight 350.436
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CAFENSTROLE

SMILES

CCN(CC)C(=O)N1C=NC(=N1)S(=O)(=O)C2=C(C)C=C(C)C=C2C

InChI

InChIKey=HFEJHAAIJZXXRE-UHFFFAOYSA-N
InChI=1S/C16H22N4O3S/c1-6-19(7-2)16(21)20-10-17-15(18-20)24(22,23)14-12(4)8-11(3)9-13(14)5/h8-10H,6-7H2,1-5H3

HIDE SMILES / InChI

Molecular Formula C16H22N4O3S
Molecular Weight 350.436
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Very-long-chain fatty acid biosynthesis is inhibited by cafenstrole, N,N-diethyl-3-mesitylsulfonyl-1H-1,2,4-triazole-1-carboxamide and its analogs.
2001 Sep-Oct
Covalent binding of chloroacetamide herbicides to the active site cysteine of plant type III polyketide synthases.
2003 Nov
Synthesis and herbicidal activity of N,N-diethyl-3-(arylselenonyl)-1H-1,2,4-triazole-1-carboxamide.
2006 Oct 4
Development and validation of a method for the analysis of cafenstrole and its metabolite in brown rice grains and rice straw using high-performance liquid chromatography.
2008 Mar
Pesticides in water, fish and shellfish from littoral area of Lake Biwa.
2009 Jun
The action of herbicides on fatty acid biosynthesis and elongation in barley and cucumber.
2010 Jul
Comparative study of human and mouse pregnane X receptor agonistic activity in 200 pesticides using in vitro reporter gene assays.
2011 Feb 27
Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:17:22 GMT 2023
Edited
by admin
on Fri Dec 15 18:17:22 GMT 2023
Record UNII
II8JP4LY7A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CAFENSTROLE
ISO  
Common Name English
GRACHITOR
Brand Name English
HIMEADOW
Brand Name English
1H-1,2,4-TRIAZOLE-1-CARBOXAMIDE, N,N-DIETHYL-3-((2,4,6-TRIMETHYLPHENYL)SULFONYL)-
Systematic Name English
CH-900
Code English
CAFENSTROLE [ISO]
Common Name English
Code System Code Type Description
CAS
125306-83-4
Created by admin on Fri Dec 15 18:17:22 GMT 2023 , Edited by admin on Fri Dec 15 18:17:22 GMT 2023
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FDA UNII
II8JP4LY7A
Created by admin on Fri Dec 15 18:17:22 GMT 2023 , Edited by admin on Fri Dec 15 18:17:22 GMT 2023
PRIMARY
ALANWOOD
cafenstrole
Created by admin on Fri Dec 15 18:17:22 GMT 2023 , Edited by admin on Fri Dec 15 18:17:22 GMT 2023
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PUBCHEM
195429
Created by admin on Fri Dec 15 18:17:22 GMT 2023 , Edited by admin on Fri Dec 15 18:17:22 GMT 2023
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EPA CompTox
DTXSID7057949
Created by admin on Fri Dec 15 18:17:22 GMT 2023 , Edited by admin on Fri Dec 15 18:17:22 GMT 2023
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