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Details

Stereochemistry ACHIRAL
Molecular Formula C17H26ClNO2
Molecular Weight 311.847
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PRETILACHLOR

SMILES

CCCOCCN(C(=O)CCl)C1=C(CC)C=CC=C1CC

InChI

InChIKey=YLPGTOIOYRQOHV-UHFFFAOYSA-N
InChI=1S/C17H26ClNO2/c1-4-11-21-12-10-19(16(20)13-18)17-14(5-2)8-7-9-15(17)6-3/h7-9H,4-6,10-13H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C17H26ClNO2
Molecular Weight 311.847
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Affinity purification using recombinant PXR as a tool to characterize environmental ligands.
2014-02
Comparative study of human and mouse pregnane X receptor agonistic activity in 200 pesticides using in vitro reporter gene assays.
2011-02-27
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.
2006-11
Identification of new human pregnane X receptor ligands among pesticides using a stable reporter cell system.
2006-06
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 19:06:31 GMT 2025
Edited
by admin
on Mon Mar 31 19:06:31 GMT 2025
Record UNII
617K7LM10D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RIFIT
Preferred Name English
PRETILACHLOR
ISO   MI  
Common Name English
PRETILACHLOR [ISO]
Common Name English
CG-113
Common Name English
2-CHLORO-N-(2,6-DIETHYLPHENYL)-N-(2-PROPOXYETHYL)ACETAMIDE
Systematic Name English
2-CHLORO-2',6'-DIETHYL-N-(2-PROPOXYETHYL)ACETANILIDE
Systematic Name English
CGA-26423
Common Name English
PRETILACHLOR [MI]
Common Name English
Code System Code Type Description
PUBCHEM
91644
Created by admin on Mon Mar 31 19:06:31 GMT 2025 , Edited by admin on Mon Mar 31 19:06:31 GMT 2025
PRIMARY
ALANWOOD
pretilachlor
Created by admin on Mon Mar 31 19:06:31 GMT 2025 , Edited by admin on Mon Mar 31 19:06:31 GMT 2025
PRIMARY
EPA CompTox
DTXSID8058112
Created by admin on Mon Mar 31 19:06:31 GMT 2025 , Edited by admin on Mon Mar 31 19:06:31 GMT 2025
PRIMARY
MESH
C118050
Created by admin on Mon Mar 31 19:06:31 GMT 2025 , Edited by admin on Mon Mar 31 19:06:31 GMT 2025
PRIMARY
MERCK INDEX
m9128
Created by admin on Mon Mar 31 19:06:31 GMT 2025 , Edited by admin on Mon Mar 31 19:06:31 GMT 2025
PRIMARY Merck Index
CAS
51218-49-6
Created by admin on Mon Mar 31 19:06:31 GMT 2025 , Edited by admin on Mon Mar 31 19:06:31 GMT 2025
PRIMARY
FDA UNII
617K7LM10D
Created by admin on Mon Mar 31 19:06:31 GMT 2025 , Edited by admin on Mon Mar 31 19:06:31 GMT 2025
PRIMARY