5-Chloro-2-mercaptobenzothiazole zinc salt

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	2C7H3ClNS2.Zn
Molecular Weight	466.786
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-Chloro-2-mercaptobenzothiazole zinc salt

Structure Search

SMILES

[Zn++].[S-]C1=NC2=CC(Cl)=CC=C2S1.[S-]C3=NC4=CC(Cl)=CC=C4S3

InChI

InChIKey=BLLNYYWMZAFCGJ-UHFFFAOYSA-L

InChI=1S/2C7H4ClNS2.Zn/c2*8-4-1-2-6-5(3-4)9-7(10)11-6;/h2*1-3H,(H,9,10);/q;;+2/p-2

HIDE SMILES / InChI

Molecular Formula	Zn
Molecular Weight	65.409
Charge	2
Count

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

Molecular Formula	C7H3ClNS2
Molecular Weight	200.688
Charge	-1
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 `Wed Apr 02 19:44:22 GMT 2025` Edited by `admin` on `Wed Apr 02 19:44:22 GMT 2025`
Record UNII	YLS3535ETY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-14871

Preferred Name

English

5-Chloro-2-mercaptobenzothiazole zinc salt

Common Name

English

2(3H)-Benzothiazolethione, 5-chloro-, zinc salt

Systematic Name

English

2(3H)-Benzothiazolethione, 5-chloro-, zinc salt (2:1)

Systematic Name

English

Classification Tree Code System Code

EPA PESTICIDE CODE

51709

Created by admin on Wed Apr 02 19:44:22 GMT 2025 , Edited by admin on Wed Apr 02 19:44:22 GMT 2025

Code System Code Type Description

PUBCHEM

90473250

Created by admin on Wed Apr 02 19:44:22 GMT 2025 , Edited by admin on Wed Apr 02 19:44:22 GMT 2025

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EPA CompTox

DTXSID3041536

Created by admin on Wed Apr 02 19:44:22 GMT 2025 , Edited by admin on Wed Apr 02 19:44:22 GMT 2025

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FDA UNII

YLS3535ETY

Created by admin on Wed Apr 02 19:44:22 GMT 2025 , Edited by admin on Wed Apr 02 19:44:22 GMT 2025

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NSC

14871

Created by admin on Wed Apr 02 19:44:22 GMT 2025 , Edited by admin on Wed Apr 02 19:44:22 GMT 2025

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CAS

53404-93-6

Created by admin on Wed Apr 02 19:44:22 GMT 2025 , Edited by admin on Wed Apr 02 19:44:22 GMT 2025

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Related Record Type Details


					R9099U429R

5-CHLORO-2-MERCAPTOBENZOTHIAZOLE

PARENT -> SALT/SOLVATE

Amount: