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Details

Stereochemistry ACHIRAL
Molecular Formula C10H9Cl4NO2S
Molecular Weight 349.061
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CAPTAFOL

SMILES

ClC(Cl)C(Cl)(Cl)SN1C(=O)[C@H]2CC=CC[C@H]2C1=O

InChI

InChIKey=JHRWWRDRBPCWTF-OLQVQODUSA-N
InChI=1S/C10H9Cl4NO2S/c11-9(12)10(13,14)18-15-7(16)5-3-1-2-4-6(5)8(15)17/h1-2,5-6,9H,3-4H2/t5-,6+

HIDE SMILES / InChI

Molecular Formula C10H9Cl4NO2S
Molecular Weight 349.061
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Induction of hsp70 in transgenic Drosophila: biomarker of exposure against phthalimide group of chemicals.
2003-05-02
The inhibitory effect of the fungicides captan and captafol on eukaryotic topoisomerases in vitro and lack of recombinagenic activity in the wing spot test of Drosophila melanogaster.
2002-07-25
Enhancing effects of captafol on the development of GST-P-positive liver cell foci in a medium-term bioassay, and protection by L-cysteine of the enhancement in rats.
1997-01-01
Interaction of glutathione transferase P1-1 with captan and captafol.
1996-07-12
Evaluation of the carcinogenic potential of pesticides. 4. Chloroalkylthiodicarboximide compounds with fungicidal activity.
1993-02
13-Week oral toxicity study of captafol in F344/DuCrj rats.
1991-08
Irritation and sensitization potential of pesticides.
1987-10
A test series for pesticide dermatitis.
1986-11
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 18:30:30 GMT 2025
Edited
by admin
on Mon Mar 31 18:30:30 GMT 2025
Record UNII
D88BWD4H64
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1H-ISOINDOLE-1,3(2H)-DIONE, 3A,4,7,7A-TETRAHYDRO-2-((1,1,2,2-TETRACHLOROETHYL)THIO)-
Preferred Name English
CAPTAFOL
HSDB   ISO   MI  
Common Name English
4-CYCLOHEXENE-1,2-DICARBOXIMIDE, N-((1,1,2,2-TETRACHLOROETHYL)THIO)-
Systematic Name English
CAPTAFOL [HSDB]
Common Name English
CAPTAFOL [ISO]
Common Name English
CAPTAFOL [MI]
Common Name English
CIS-CAPTAFOL
Common Name English
N-((1,1,2,2-TETRACHLOROETHYL)THIO)-4-CYCLOHEXENE-1,2-DICARBOXIMIDE
Common Name English
N-((1,1,2,2-TETRACHLOROETHYL)THIO-4-CYCLOHEXENE-1,2-DICARBOXIMIDE, CIS-
Common Name English
CAPTAFOL [IARC]
Common Name English
1H-ISOINDOLE-1,3(2H)-DIONE, 3A,4,7,7A-TETRAHYDRO-2-((1,1,2,2-TETRACHLOROETHYL)THIO)-, (3AR,7AS)-REL-
Systematic Name English
DIFOLATAN
Common Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 81702
Created by admin on Mon Mar 31 18:30:30 GMT 2025 , Edited by admin on Mon Mar 31 18:30:30 GMT 2025
EPA PESTICIDE CODE 81701
Created by admin on Mon Mar 31 18:30:30 GMT 2025 , Edited by admin on Mon Mar 31 18:30:30 GMT 2025
NCI_THESAURUS C737
Created by admin on Mon Mar 31 18:30:30 GMT 2025 , Edited by admin on Mon Mar 31 18:30:30 GMT 2025
Code System Code Type Description
EPA CompTox
DTXSID4020242
Created by admin on Mon Mar 31 18:30:30 GMT 2025 , Edited by admin on Mon Mar 31 18:30:30 GMT 2025
PRIMARY
PUBCHEM
16760159
Created by admin on Mon Mar 31 18:30:30 GMT 2025 , Edited by admin on Mon Mar 31 18:30:30 GMT 2025
PRIMARY
MESH
C001614
Created by admin on Mon Mar 31 18:30:30 GMT 2025 , Edited by admin on Mon Mar 31 18:30:30 GMT 2025
PRIMARY
NCI_THESAURUS
C77381
Created by admin on Mon Mar 31 18:30:30 GMT 2025 , Edited by admin on Mon Mar 31 18:30:30 GMT 2025
PRIMARY
CHEBI
81938
Created by admin on Mon Mar 31 18:30:30 GMT 2025 , Edited by admin on Mon Mar 31 18:30:30 GMT 2025
PRIMARY
FDA UNII
D88BWD4H64
Created by admin on Mon Mar 31 18:30:30 GMT 2025 , Edited by admin on Mon Mar 31 18:30:30 GMT 2025
PRIMARY
ECHA (EC/EINECS)
219-363-3
Created by admin on Mon Mar 31 18:30:30 GMT 2025 , Edited by admin on Mon Mar 31 18:30:30 GMT 2025
PRIMARY
ALANWOOD
captafol
Created by admin on Mon Mar 31 18:30:30 GMT 2025 , Edited by admin on Mon Mar 31 18:30:30 GMT 2025
PRIMARY
CAS
2939-80-2
Created by admin on Mon Mar 31 18:30:30 GMT 2025 , Edited by admin on Mon Mar 31 18:30:30 GMT 2025
ALTERNATIVE
CAS
2425-06-1
Created by admin on Mon Mar 31 18:30:30 GMT 2025 , Edited by admin on Mon Mar 31 18:30:30 GMT 2025
PRIMARY
MERCK INDEX
m3043
Created by admin on Mon Mar 31 18:30:30 GMT 2025 , Edited by admin on Mon Mar 31 18:30:30 GMT 2025
PRIMARY Merck Index
SMS_ID
300000053206
Created by admin on Mon Mar 31 18:30:30 GMT 2025 , Edited by admin on Mon Mar 31 18:30:30 GMT 2025
PRIMARY
HSDB
340
Created by admin on Mon Mar 31 18:30:30 GMT 2025 , Edited by admin on Mon Mar 31 18:30:30 GMT 2025
PRIMARY
WIKIPEDIA
CAPTAFOL
Created by admin on Mon Mar 31 18:30:30 GMT 2025 , Edited by admin on Mon Mar 31 18:30:30 GMT 2025
PRIMARY