CAPTAFOL

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NCATS

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

Structure Search

SMILES

[H][C@@]12CC=CC[C@]1([H])C(=O)N(SC(Cl)(Cl)C(Cl)Cl)C2=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

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:31:36 UTC 2023` Edited by `admin` on `Fri Dec 15 16:31:36 UTC 2023`
Record UNII	D88BWD4H64
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

CAPTAFOL

Common Name

English

1H-ISOINDOLE-1,3(2H)-DIONE, 3A,4,7,7A-TETRAHYDRO-2-((1,1,2,2-TETRACHLOROETHYL)THIO)-

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 Fri Dec 15 16:31:37 UTC 2023 , Edited by admin on Fri Dec 15 16:31:37 UTC 2023

EPA PESTICIDE CODE

81701

Created by admin on Fri Dec 15 16:31:37 UTC 2023 , Edited by admin on Fri Dec 15 16:31:37 UTC 2023

NCI_THESAURUS

C737

Created by admin on Fri Dec 15 16:31:37 UTC 2023 , Edited by admin on Fri Dec 15 16:31:37 UTC 2023

Code System Code Type Description

EPA CompTox

DTXSID4020242

Created by admin on Fri Dec 15 16:31:37 UTC 2023 , Edited by admin on Fri Dec 15 16:31:37 UTC 2023

PRIMARY

PUBCHEM

16760159

Created by admin on Fri Dec 15 16:31:37 UTC 2023 , Edited by admin on Fri Dec 15 16:31:37 UTC 2023

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MESH

C001614

Created by admin on Fri Dec 15 16:31:37 UTC 2023 , Edited by admin on Fri Dec 15 16:31:37 UTC 2023

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NCI_THESAURUS

C77381

Created by admin on Fri Dec 15 16:31:37 UTC 2023 , Edited by admin on Fri Dec 15 16:31:37 UTC 2023

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CHEBI

81938

Created by admin on Fri Dec 15 16:31:37 UTC 2023 , Edited by admin on Fri Dec 15 16:31:37 UTC 2023

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FDA UNII

D88BWD4H64

Created by admin on Fri Dec 15 16:31:37 UTC 2023 , Edited by admin on Fri Dec 15 16:31:37 UTC 2023

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ECHA (EC/EINECS)

219-363-3

Created by admin on Fri Dec 15 16:31:37 UTC 2023 , Edited by admin on Fri Dec 15 16:31:37 UTC 2023

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ALANWOOD

captafol

Created by admin on Fri Dec 15 16:31:37 UTC 2023 , Edited by admin on Fri Dec 15 16:31:37 UTC 2023

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CAS

2939-80-2

Created by admin on Fri Dec 15 16:31:37 UTC 2023 , Edited by admin on Fri Dec 15 16:31:37 UTC 2023

ALTERNATIVE

CAS

2425-06-1

Created by admin on Fri Dec 15 16:31:37 UTC 2023 , Edited by admin on Fri Dec 15 16:31:37 UTC 2023

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MERCK INDEX

m3043

Created by admin on Fri Dec 15 16:31:37 UTC 2023 , Edited by admin on Fri Dec 15 16:31:37 UTC 2023

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Merck Index

HSDB

340

Created by admin on Fri Dec 15 16:31:37 UTC 2023 , Edited by admin on Fri Dec 15 16:31:37 UTC 2023

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WIKIPEDIA

CAPTAFOL

Created by admin on Fri Dec 15 16:31:37 UTC 2023 , Edited by admin on Fri Dec 15 16:31:37 UTC 2023

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