4-[7-[6-Cyano-5-(trifluoromethyl)-3-pyridinyl]-6,8-dithioxo-5,7-diazaspiro[3.4]oct-5-yl]-2-fluoro-N-methylbenzamide

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H15F4N5OS2
Molecular Weight	493.5
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-[7-[6-Cyano-5-(trifluoromethyl)-3-pyridinyl]-6,8-dithioxo-5,7-diazaspiro[3.4]oct-5-yl]-2-fluoro-N-methylbenzamide

Structure Search

SMILES

CNC(=O)C1=CC=C(C=C1F)N2C(=S)N(C(=S)C23CCC3)C4=CN=C(C#N)C(=C4)C(F)(F)F

InChI

InChIKey=HWMKCWCULGRTPT-UHFFFAOYSA-N

InChI=1S/C21H15F4N5OS2/c1-27-17(31)13-4-3-11(8-15(13)22)30-19(33)29(18(32)20(30)5-2-6-20)12-7-14(21(23,24)25)16(9-26)28-10-12/h3-4,7-8,10H,2,5-6H2,1H3,(H,27,31)

HIDE SMILES / InChI

Molecular Formula	C21H15F4N5OS2
Molecular Weight	493.5
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 `Wed Apr 02 14:52:09 GMT 2025` Edited by `admin` on `Wed Apr 02 14:52:09 GMT 2025`
Record UNII	A5X3E9SZ2V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-[7-[6-cyano-5-(trifluoromethyl)pyridin-3-yl]-6,8-bis(sulfanylidene)-5,7-diazaspiro[3.4]octan-5-yl]-2-fluoro-N-methylbenzamide

Preferred Name

English

4-[7-[6-Cyano-5-(trifluoromethyl)-3-pyridinyl]-6,8-dithioxo-5,7-diazaspiro[3.4]oct-5-yl]-2-fluoro-N-methylbenzamide

Systematic Name

English

Benzamide, 4-[7-[6-cyano-5-(trifluoromethyl)-3-pyridinyl]-6,8-dithioxo-5,7-diazaspiro[3.4]oct-5-yl]-2-fluoro-N-methyl-

Systematic Name

English

Code System Code Type Description

CAS

2649802-40-2

Created by admin on Wed Apr 02 14:52:09 GMT 2025 , Edited by admin on Wed Apr 02 14:52:09 GMT 2025

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FDA UNII

A5X3E9SZ2V

Created by admin on Wed Apr 02 14:52:09 GMT 2025 , Edited by admin on Wed Apr 02 14:52:09 GMT 2025

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PUBCHEM

90285304

Created by admin on Wed Apr 02 14:52:09 GMT 2025 , Edited by admin on Wed Apr 02 14:52:09 GMT 2025

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