4-(4-NITROPHENYL)-1,3-DITHIOL-2-ONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H5NO3S2
Molecular Weight	239.271
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-(4-NITROPHENYL)-1,3-DITHIOL-2-ONE

Structure Search

SMILES

[O-][N+](=O)C1=CC=C(C=C1)C2=CSC(=O)S2

InChI

InChIKey=KGMIAMWJADHAOQ-UHFFFAOYSA-N

InChI=1S/C9H5NO3S2/c11-9-14-5-8(15-9)6-1-3-7(4-2-6)10(12)13/h1-5H

HIDE SMILES / InChI

Molecular Formula	C9H5NO3S2
Molecular Weight	239.271
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 `Sat Dec 16 12:55:01 GMT 2023` Edited by `admin` on `Sat Dec 16 12:55:01 GMT 2023`
Record UNII	YH8TB4JKB9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-(4-NITROPHENYL)-1,3-DITHIOL-2-ONE

Common Name

English

1,3-DITHIOL-2-ONE, 4-(4-NITROPHENYL)-

Common Name

English

4-(4-(HYDROXY(OXIDO)AMINO)PHENYL)-1,3-DITHIOL-2-ONE

Systematic Name

English

NSC-208891

Code

English

Code System Code Type Description

EPA CompTox

DTXSID00197964

Created by admin on Sat Dec 16 12:55:01 GMT 2023 , Edited by admin on Sat Dec 16 12:55:01 GMT 2023

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NSC

208891

Created by admin on Sat Dec 16 12:55:01 GMT 2023 , Edited by admin on Sat Dec 16 12:55:01 GMT 2023

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PUBCHEM

308202

Created by admin on Sat Dec 16 12:55:01 GMT 2023 , Edited by admin on Sat Dec 16 12:55:01 GMT 2023

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CAS

49675-85-6

Created by admin on Sat Dec 16 12:55:01 GMT 2023 , Edited by admin on Sat Dec 16 12:55:01 GMT 2023

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FDA UNII

YH8TB4JKB9

Created by admin on Sat Dec 16 12:55:01 GMT 2023 , Edited by admin on Sat Dec 16 12:55:01 GMT 2023

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