5-Chloro-2-mercaptobenzoxazole

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H4ClNOS
Molecular Weight	185.631
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-Chloro-2-mercaptobenzoxazole

Structure Search

SMILES

ClC1=CC2=C(OC(=S)N2)C=C1

InChI

InChIKey=BOBIZYYFYLLRAH-UHFFFAOYSA-N

InChI=1S/C7H4ClNOS/c8-4-1-2-6-5(3-4)9-7(11)10-6/h1-3H,(H,9,11)

HIDE SMILES / InChI

Molecular Formula	C7H4ClNOS
Molecular Weight	185.631
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 `Tue Apr 01 19:50:04 GMT 2025` Edited by `admin` on `Tue Apr 01 19:50:04 GMT 2025`
Record UNII	2D3DP73PWF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-26187

Preferred Name

English

5-Chloro-2-mercaptobenzoxazole

Systematic Name

English

2(3H)-Benzoxazolethione, 5-chloro-

Systematic Name

English

Benzoxazole, 5-chloro-2-mercapto-

Systematic Name

English

5-Chloro-2(3H)-benzoxazolethione

Systematic Name

English

Code System Code Type Description

NSC

26187

Created by admin on Tue Apr 01 19:50:04 GMT 2025 , Edited by admin on Tue Apr 01 19:50:04 GMT 2025

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EPA CompTox

DTXSID10177419

Created by admin on Tue Apr 01 19:50:04 GMT 2025 , Edited by admin on Tue Apr 01 19:50:04 GMT 2025

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FDA UNII

2D3DP73PWF

Created by admin on Tue Apr 01 19:50:04 GMT 2025 , Edited by admin on Tue Apr 01 19:50:04 GMT 2025

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CAS

22876-19-3

Created by admin on Tue Apr 01 19:50:04 GMT 2025 , Edited by admin on Tue Apr 01 19:50:04 GMT 2025

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PUBCHEM

708870

Created by admin on Tue Apr 01 19:50:04 GMT 2025 , Edited by admin on Tue Apr 01 19:50:04 GMT 2025

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