5-Amino-4-bromo-6H-anthra(9,1-cd)isothiazol-6-one

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H7BrN2OS
Molecular Weight	331.187
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-Amino-4-bromo-6H-anthra(9,1-cd)isothiazol-6-one

Structure Search

SMILES

NC1=C2C3=C(SN=C3C4=C(C=CC=C4)C2=O)C=C1Br

InChI

InChIKey=JYVZVTJUNHUKFD-UHFFFAOYSA-N

InChI=1S/C14H7BrN2OS/c15-8-5-9-10-11(12(8)16)14(18)7-4-2-1-3-6(7)13(10)17-19-9/h1-5H,16H2

HIDE SMILES / InChI

Molecular Formula	C14H7BrN2OS
Molecular Weight	331.187
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 20:01:57 GMT 2025` Edited by `admin` on `Tue Apr 01 20:01:57 GMT 2025`
Record UNII	FDN42C4KL6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-39873

Preferred Name

English

5-Amino-4-bromo-6H-anthra(9,1-cd)isothiazol-6-one

Systematic Name

English

6H-Anthra[9,1-cd]isothiazol-6-one, 5-amino-4-bromo-

Common Name

English

Code System Code Type Description

FDA UNII

FDN42C4KL6

Created by admin on Tue Apr 01 20:01:57 GMT 2025 , Edited by admin on Tue Apr 01 20:01:57 GMT 2025

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EPA CompTox

DTXSID10219449

Created by admin on Tue Apr 01 20:01:57 GMT 2025 , Edited by admin on Tue Apr 01 20:01:57 GMT 2025

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NSC

39873

Created by admin on Tue Apr 01 20:01:57 GMT 2025 , Edited by admin on Tue Apr 01 20:01:57 GMT 2025

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PUBCHEM

236859

Created by admin on Tue Apr 01 20:01:57 GMT 2025 , Edited by admin on Tue Apr 01 20:01:57 GMT 2025

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CAS

6936-99-8

Created by admin on Tue Apr 01 20:01:57 GMT 2025 , Edited by admin on Tue Apr 01 20:01:57 GMT 2025

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