7-bromo-5-methyl-4-nitro-2,1,3-benzothiadiazole

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H4BrN3O2S
Molecular Weight	274.095
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 7-bromo-5-methyl-4-nitro-2,1,3-benzothiadiazole

Structure Search

SMILES

CC1=C(C2=NSN=C2C(Br)=C1)[N+]([O-])=O

InChI

InChIKey=HUMWHYXXWVTAQW-UHFFFAOYSA-N

InChI=1S/C7H4BrN3O2S/c1-3-2-4(8)5-6(10-14-9-5)7(3)11(12)13/h2H,1H3

HIDE SMILES / InChI

Molecular Formula	C7H4BrN3O2S
Molecular Weight	274.095
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 20:04:06 GMT 2025` Edited by `admin` on `Tue Apr 01 20:04:06 GMT 2025`
Record UNII	DVJ4FFY2K9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-331798

Preferred Name

English

7-bromo-5-methyl-4-nitro-2,1,3-benzothiadiazole

Systematic Name

English

7-BROMO-4-(HYDROXY(OXIDO)AMINO)-5-METHYL-2,1,3-BENZOTHIADIAZOLE

Systematic Name

English

2,1,3-Benzothiadiazole, 7-bromo-5-methyl-4-nitro-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID00220988

Created by admin on Tue Apr 01 20:04:06 GMT 2025 , Edited by admin on Tue Apr 01 20:04:06 GMT 2025

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NSC

331798

Created by admin on Tue Apr 01 20:04:06 GMT 2025 , Edited by admin on Tue Apr 01 20:04:06 GMT 2025

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PUBCHEM

332746

Created by admin on Tue Apr 01 20:04:06 GMT 2025 , Edited by admin on Tue Apr 01 20:04:06 GMT 2025

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FDA UNII

DVJ4FFY2K9

Created by admin on Tue Apr 01 20:04:06 GMT 2025 , Edited by admin on Tue Apr 01 20:04:06 GMT 2025

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CAS

70733-29-8

Created by admin on Tue Apr 01 20:04:06 GMT 2025 , Edited by admin on Tue Apr 01 20:04:06 GMT 2025

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