PXS-5505

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H13FN2O2S
Molecular Weight	280.318
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of PXS-5505

Structure Search

SMILES

NC\C=C(/F)CS(=O)(=O)C1=C2N=CC=CC2=CC=C1

InChI

InChIKey=DHXXLGDTPFPYRH-WDZFZDKYSA-N

InChI=1S/C13H13FN2O2S/c14-11(6-7-15)9-19(17,18)12-5-1-3-10-4-2-8-16-13(10)12/h1-6,8H,7,9,15H2/b11-6-

HIDE SMILES / InChI

Molecular Formula	C13H13FN2O2S
Molecular Weight	280.318
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 16:33:48 UTC 2023` Edited by `admin` on `Sat Dec 16 16:33:48 UTC 2023`
Record UNII	DO94E28WYW
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

PXS-5505

Code

English

2-BUTEN-1-AMINE, 3-FLUORO-4-(8-QUINOLINYLSULFONYL)-, (2Z)-

Systematic Name

English

Classification Tree Code System Code

FDA ORPHAN DRUG

747520

Created by admin on Sat Dec 16 16:33:49 UTC 2023 , Edited by admin on Sat Dec 16 16:33:49 UTC 2023

Code System Code Type Description

FDA UNII

DO94E28WYW

Created by admin on Sat Dec 16 16:33:49 UTC 2023 , Edited by admin on Sat Dec 16 16:33:49 UTC 2023

PRIMARY

CAS

2409963-83-1

Created by admin on Sat Dec 16 16:33:49 UTC 2023 , Edited by admin on Sat Dec 16 16:33:49 UTC 2023

PRIMARY

NCI_THESAURUS

C179584

Created by admin on Sat Dec 16 16:33:49 UTC 2023 , Edited by admin on Sat Dec 16 16:33:49 UTC 2023

PRIMARY

PUBCHEM

146317833

Created by admin on Sat Dec 16 16:33:49 UTC 2023 , Edited by admin on Sat Dec 16 16:33:49 UTC 2023

PRIMARY

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