3-(Methylthio)phenylaniline

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H13NS
Molecular Weight	215.314
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-(Methylthio)phenylaniline

Structure Search

SMILES

CSC1=CC=CC(NC2=CC=CC=C2)=C1

InChI

InChIKey=NGTRZJDYCCOXBA-UHFFFAOYSA-N

InChI=1S/C13H13NS/c1-15-13-9-5-8-12(10-13)14-11-6-3-2-4-7-11/h2-10,14H,1H3

HIDE SMILES / InChI

Molecular Formula	C13H13NS
Molecular Weight	215.314
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:00:34 GMT 2023` Edited by `admin` on `Sat Dec 16 12:00:34 GMT 2023`
Record UNII	BX9YL26URT
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3-(Methylthio)phenylaniline

Common Name

English

3-(Methylthio)-N-phenylbenzenamine

Systematic Name

English

Benzenamine, 3-(methylthio)-N-phenyl-

Systematic Name

English

3-(Methylthio)-N-phenylaniline

Systematic Name

English

Code System Code Type Description

CAS

13313-45-6

Created by admin on Sat Dec 16 12:00:34 GMT 2023 , Edited by admin on Sat Dec 16 12:00:34 GMT 2023

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PUBCHEM

83333

Created by admin on Sat Dec 16 12:00:34 GMT 2023 , Edited by admin on Sat Dec 16 12:00:34 GMT 2023

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EPA CompTox

DTXSID7065411

Created by admin on Sat Dec 16 12:00:34 GMT 2023 , Edited by admin on Sat Dec 16 12:00:34 GMT 2023

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FDA UNII

BX9YL26URT

Created by admin on Sat Dec 16 12:00:34 GMT 2023 , Edited by admin on Sat Dec 16 12:00:34 GMT 2023

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ECHA (EC/EINECS)

236-342-4

Created by admin on Sat Dec 16 12:00:34 GMT 2023 , Edited by admin on Sat Dec 16 12:00:34 GMT 2023

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