4-nitro-7-phenylsulfanyl-benzo[1,2,5]oxadiazole 1-oxide

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H7N3O4S
Molecular Weight	289.267
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-nitro-7-phenylsulfanyl-benzo[1,2,5]oxadiazole 1-oxide

Structure Search

SMILES

[O-][N+](=O)C1=CC=C(SC2=CC=CC=C2)C3=[N+]([O-])ON=C13

InChI

InChIKey=NHDVXPDPUYQSNH-UHFFFAOYSA-N

InChI=1S/C12H7N3O4S/c16-14(17)9-6-7-10(12-11(9)13-19-15(12)18)20-8-4-2-1-3-5-8/h1-7H

HIDE SMILES / InChI

Molecular Formula	C12H7N3O4S
Molecular Weight	289.267
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 20:39:45 GMT 2025` Edited by `admin` on `Tue Apr 01 20:39:45 GMT 2025`
Record UNII	7VJ3WXH9NU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-nitro-7-phenylsulfanyl-benzo[1,2,5]oxadiazole 1-oxide

Systematic Name

English

NSC-228112

Preferred Name

English

2,1,3-Benzoxadiazole, 4-nitro-7-(phenylthio)-, 1-oxide

Systematic Name

English

BENZOFURAZAN, 4-NITRO-7-PHENYLTHIO-, 1-OXIDE

Systematic Name

English

Code System Code Type Description

CAS

18378-06-8

Created by admin on Tue Apr 01 20:39:45 GMT 2025 , Edited by admin on Tue Apr 01 20:39:45 GMT 2025

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NSC

228112

Created by admin on Tue Apr 01 20:39:45 GMT 2025 , Edited by admin on Tue Apr 01 20:39:45 GMT 2025

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FDA UNII

7VJ3WXH9NU

Created by admin on Tue Apr 01 20:39:45 GMT 2025 , Edited by admin on Tue Apr 01 20:39:45 GMT 2025

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PUBCHEM

29048

Created by admin on Tue Apr 01 20:39:45 GMT 2025 , Edited by admin on Tue Apr 01 20:39:45 GMT 2025

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EPA CompTox

DTXSID10171472

Created by admin on Tue Apr 01 20:39:45 GMT 2025 , Edited by admin on Tue Apr 01 20:39:45 GMT 2025

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