4,4'-THIODIANILINE

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 Search

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

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/21863124 | https://www.ncbi.nlm.nih.gov/pubmed/19632831

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

Originator

Approval Year

Conditions

Condition	Modality	Targets	Highest Phase	Product
Epilepsy 121 Sources: https://www.ncbi.nlm.nih.gov/pubmed/19632831	Primary		Preclinical	Unknown Approved Use Unknown

PubMed

Title	Date	PubMed
Synergistic enhancement of thyroid tumor induction by 2,4-diaminoanisole sulfate, N,N'-diethylthiourea and 4,4'-thiodianiline in male F344 rats.	1991 Aug	1907225
Degradability of selected azo dye metabolites in activated sludge systems.	2001 Aug	11482661
Carcinogenic effect of combined administration of 2,4-diaminoanisole sulfate, 4,4'-thiodianiline and N,N'-diethylthiourea in male Wistar rats.	2002	12382023
4,4'-Thiodianiline.	2004	21089967
DNA fragmentation and DNA repair synthesis induced in rat and human thyroid cells by four rat thyroid carcinogens.	2005 Mar 1	15710170
In vivo evaluation of diaminodiphenyls: anticonvulsant agents with minimal acute neurotoxicity.	2009 Sep 1	19632831

Patents

Sample Use Guides

In Vivo Use Guide

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

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Name

Type

Language

4,4'-THIODIANILINE

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