JJC-323

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H6N6O2S
Molecular Weight	226.216
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of JJC-323

Structure Search

SMILES

CN1C=NC(=C1SC2=NN=CN2)[N+]([O-])=O

InChI

InChIKey=YUPUITJUYVPDSP-UHFFFAOYSA-N

InChI=1S/C6H6N6O2S/c1-11-3-8-4(12(13)14)5(11)15-6-7-2-9-10-6/h2-3H,1H3,(H,7,9,10)

HIDE SMILES / InChI

Molecular Formula	C6H6N6O2S
Molecular Weight	226.216
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 12:44:11 GMT 2023` Edited by `admin` on `Sat Dec 16 12:44:11 GMT 2023`
Record UNII	49B854MT5P
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

JJC-323

Code

English

1H-1,2,4-TRIAZOLE, 5-((1-METHYL-4-NITRO-1H-IMIDAZOL-5-YL)THIO)-

Systematic Name

English

NSC-631155

Code

English

NSC-311074

Code

English

Code System Code Type Description

NSC

311074

Created by admin on Sat Dec 16 12:44:11 GMT 2023 , Edited by admin on Sat Dec 16 12:44:11 GMT 2023

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PUBCHEM

100514

Created by admin on Sat Dec 16 12:44:11 GMT 2023 , Edited by admin on Sat Dec 16 12:44:11 GMT 2023

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CAS

91300-62-8

Created by admin on Sat Dec 16 12:44:11 GMT 2023 , Edited by admin on Sat Dec 16 12:44:11 GMT 2023

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FDA UNII

49B854MT5P

Created by admin on Sat Dec 16 12:44:11 GMT 2023 , Edited by admin on Sat Dec 16 12:44:11 GMT 2023

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EPA CompTox

DTXSID20238489

Created by admin on Sat Dec 16 12:44:11 GMT 2023 , Edited by admin on Sat Dec 16 12:44:11 GMT 2023

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NSC

631155

Created by admin on Sat Dec 16 12:44:11 GMT 2023 , Edited by admin on Sat Dec 16 12:44:11 GMT 2023

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