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Details

Stereochemistry ACHIRAL
Molecular Formula C12H12N2S
Molecular Weight 216.302
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4,4'-THIODIANILINE

SMILES

NC1=CC=C(SC2=CC=C(N)C=C2)C=C1

InChI

InChIKey=ICNFHJVPAJKPHW-UHFFFAOYSA-N
InChI=1S/C12H12N2S/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H,13-14H2

HIDE SMILES / InChI

Molecular Formula C12H12N2S
Molecular Weight 216.302
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

4,4'-Thiodianiline is a chemical intermediate that was used in a production of mordant yellow and other dyes. 4,4'-Thiodianiline is reasonably anticipated to be a human carcinogen based on sufficient evidence of carcinogenicity from studies in experimental animals. 4,4'-Thiodianiline has demonstrated anticonvulsant activity in vivo.

CNS Activity

Curator's Comment: Active in rats in the model of epilepsy

Approval Year

Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
Primary
Unknown

Approved Use

Unknown
PubMed

PubMed

TitleDatePubMed
DNA fragmentation and DNA repair synthesis induced in rat and human thyroid cells by four rat thyroid carcinogens.
2005 Mar 1
Patents

Sample Use Guides

In a model of epilepsy, the compound was administered to rats intraperitoneally at 30 mg/kg
Route of Administration: Intraperitoneal
In Vitro Use Guide
Unknown
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:59:21 GMT 2023
Edited
by admin
on Fri Dec 15 15:59:21 GMT 2023
Record UNII
6GGU990BQF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4,4'-THIODIANILINE
HSDB  
Systematic Name English
BENZENAMINE, 4,4'-THIOBIS-
Systematic Name English
4,4'-THIODIANILINE [IARC]
Common Name English
BAPS
Common Name English
4,4'-THIOBISBENZENAMINE
Systematic Name English
BIS(P-AMINOPHENYL) SULFIDE
Common Name English
DI(P-AMINOPHENYL) SULFIDE
Common Name English
NSC-6191
Code English
4,4'-THIODIANILINE [HSDB]
Common Name English
P,P'-DIAMINODIPHENYL SULFIDE
Common Name English
NCI-C01707
Code English
Code System Code Type Description
NCI_THESAURUS
C44322
Created by admin on Fri Dec 15 15:59:21 GMT 2023 , Edited by admin on Fri Dec 15 15:59:21 GMT 2023
PRIMARY
WIKIPEDIA
4,4'-Thiodianiline
Created by admin on Fri Dec 15 15:59:21 GMT 2023 , Edited by admin on Fri Dec 15 15:59:21 GMT 2023
PRIMARY
MESH
C011749
Created by admin on Fri Dec 15 15:59:21 GMT 2023 , Edited by admin on Fri Dec 15 15:59:21 GMT 2023
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EPA CompTox
DTXSID9021344
Created by admin on Fri Dec 15 15:59:21 GMT 2023 , Edited by admin on Fri Dec 15 15:59:21 GMT 2023
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ECHA (EC/EINECS)
205-370-9
Created by admin on Fri Dec 15 15:59:21 GMT 2023 , Edited by admin on Fri Dec 15 15:59:21 GMT 2023
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FDA UNII
6GGU990BQF
Created by admin on Fri Dec 15 15:59:21 GMT 2023 , Edited by admin on Fri Dec 15 15:59:21 GMT 2023
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NSC
6191
Created by admin on Fri Dec 15 15:59:21 GMT 2023 , Edited by admin on Fri Dec 15 15:59:21 GMT 2023
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PUBCHEM
8765
Created by admin on Fri Dec 15 15:59:21 GMT 2023 , Edited by admin on Fri Dec 15 15:59:21 GMT 2023
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CAS
139-65-1
Created by admin on Fri Dec 15 15:59:21 GMT 2023 , Edited by admin on Fri Dec 15 15:59:21 GMT 2023
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HSDB
5074
Created by admin on Fri Dec 15 15:59:21 GMT 2023 , Edited by admin on Fri Dec 15 15:59:21 GMT 2023
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