3,7-DINITRO-5-OXOPHENOTHIAZINE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H7N3O5S
Molecular Weight	305.266
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,7-DINITRO-5-OXOPHENOTHIAZINE

Structure Search

SMILES

[O-][S+]1C2=CC(=CC=C2NC3=CC=C(C=C13)[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=VCYRBORHWHUNIK-UHFFFAOYSA-N

InChI=1S/C12H7N3O5S/c16-14(17)7-1-3-9-11(5-7)21(20)12-6-8(15(18)19)2-4-10(12)13-9/h1-6,13H

HIDE SMILES / InChI

Molecular Formula	C12H7N3O5S
Molecular Weight	305.266
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:15:07 GMT 2023` Edited by `admin` on `Sat Dec 16 09:15:07 GMT 2023`
Record UNII	4750596FET
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3,7-DINITRO-5-OXOPHENOTHIAZINE

Systematic Name

English

NSC-18426

Code

English

3,7-DINITROPHENOTHIAZINE SULFOXIDE

Common Name

English

3,7-DINITRO-10H-PHENOTHIAZINE 5-OXIDE

Systematic Name

English

DINITRODIPHENYLAMINE SULFOXIDE

Common Name

English

3,7-DINITRO-5-OXOPHENOTHIAZINE [MI]

Common Name

English

Code System Code Type Description

NSC

18426

Created by admin on Sat Dec 16 09:15:07 GMT 2023 , Edited by admin on Sat Dec 16 09:15:07 GMT 2023

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FDA UNII

4750596FET

Created by admin on Sat Dec 16 09:15:07 GMT 2023 , Edited by admin on Sat Dec 16 09:15:07 GMT 2023

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EPA CompTox

DTXSID40205991

Created by admin on Sat Dec 16 09:15:07 GMT 2023 , Edited by admin on Sat Dec 16 09:15:07 GMT 2023

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CAS

574-81-2

Created by admin on Sat Dec 16 09:15:07 GMT 2023 , Edited by admin on Sat Dec 16 09:15:07 GMT 2023

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ECHA (EC/EINECS)

209-375-7

Created by admin on Sat Dec 16 09:15:07 GMT 2023 , Edited by admin on Sat Dec 16 09:15:07 GMT 2023

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PUBCHEM

3420028

Created by admin on Sat Dec 16 09:15:07 GMT 2023 , Edited by admin on Sat Dec 16 09:15:07 GMT 2023

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MERCK INDEX

m700

Created by admin on Sat Dec 16 09:15:07 GMT 2023 , Edited by admin on Sat Dec 16 09:15:07 GMT 2023

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Merck Index