ZINC 2-MERCAPTOBENZOTHIAZOLE

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	2C7H4NS2.Zn
Molecular Weight	397.896
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ZINC 2-MERCAPTOBENZOTHIAZOLE

Structure Search

SMILES

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

InChI

InChIKey=PGNWIWKMXVDXHP-UHFFFAOYSA-L

InChI=1S/2C7H5NS2.Zn/c2*9-7-8-5-3-1-2-4-6(5)10-7;/h2*1-4H,(H,8,9);/q;;+2/p-2

HIDE SMILES / InChI

Molecular Formula	C7H5NS2
Molecular Weight	167.251
Charge	0
Count

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

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:57:43 GMT 2025` Edited by `admin` on `Mon Mar 31 19:57:43 GMT 2025`
Record UNII	HMM5IX9Q3B
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ZINC MERCAPTOBENZOTHIAZOLE [HSDB]

Preferred Name

English

ZINC 2-MERCAPTOBENZOTHIAZOLE

Systematic Name

English

NSC-285168

Code

English

Classification Tree Code System Code

EPA PESTICIDE CODE

51705

Created by admin on Mon Mar 31 19:57:43 GMT 2025 , Edited by admin on Mon Mar 31 19:57:43 GMT 2025

Code System Code Type Description

PUBCHEM

9071

Created by admin on Mon Mar 31 19:57:43 GMT 2025 , Edited by admin on Mon Mar 31 19:57:43 GMT 2025

PRIMARY

ECHA (EC/EINECS)

205-840-3

Created by admin on Mon Mar 31 19:57:43 GMT 2025 , Edited by admin on Mon Mar 31 19:57:43 GMT 2025

PRIMARY

NSC

285168

Created by admin on Mon Mar 31 19:57:43 GMT 2025 , Edited by admin on Mon Mar 31 19:57:43 GMT 2025

PRIMARY

EPA CompTox

DTXSID6020808

Created by admin on Mon Mar 31 19:57:43 GMT 2025 , Edited by admin on Mon Mar 31 19:57:43 GMT 2025

PRIMARY

CAS

155-04-4

Created by admin on Mon Mar 31 19:57:43 GMT 2025 , Edited by admin on Mon Mar 31 19:57:43 GMT 2025

PRIMARY

HSDB

5419

Created by admin on Mon Mar 31 19:57:43 GMT 2025 , Edited by admin on Mon Mar 31 19:57:43 GMT 2025

PRIMARY

FDA UNII

HMM5IX9Q3B

Created by admin on Mon Mar 31 19:57:43 GMT 2025 , Edited by admin on Mon Mar 31 19:57:43 GMT 2025

PRIMARY

Related Record Type Details


					5RLR54Z22K

2-Mercaptobenzothiazole

PARENT -> SALT/SOLVATE

Amount:


					5RLR54Z22K

2-Mercaptobenzothiazole

PARENT -> SALT/SOLVATE


					13S1S8SF37

PARENT -> SALT/SOLVATE