SIBENADET

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H28N2O5S2
Molecular Weight	464.598
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of SIBENADET

Structure Search

SMILES

OC1=C2NC(=O)SC2=C(CCNCCS(=O)(=O)CCCOCCC3=CC=CC=C3)C=C1

InChI

InChIKey=DBCKRBGYGMVSTI-UHFFFAOYSA-N

InChI=1S/C22H28N2O5S2/c25-19-8-7-18(21-20(19)24-22(26)30-21)9-11-23-12-16-31(27,28)15-4-13-29-14-10-17-5-2-1-3-6-17/h1-3,5-8,23,25H,4,9-16H2,(H,24,26)

HIDE SMILES / InChI

Molecular Formula	C22H28N2O5S2
Molecular Weight	464.598
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 `Fri Dec 15 15:42:07 UTC 2023` Edited by `admin` on `Fri Dec 15 15:42:07 UTC 2023`
Record UNII	N32934RHGW
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

SIBENADET

Official Name

English

4-HYDROXY-7-(2-((2-((3-(2-PHENYLETHOXY)PROPYL)SULFONYL)ETHYL)AMINO)ETHYL)-1,3-BENZOTHIAZOL-2(3H)-ONE

Systematic Name

English

2(3H)-BENZOTHIAZOLONE, 4-HYDROXY-7-(2-((2-((3-(2-PHENYLETHOXY)PROPYL)SULFONYL)ETHYL)AMINO)ETHYL)-

Systematic Name

English

sibenadet [INN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C48149

Created by admin on Fri Dec 15 15:42:07 UTC 2023 , Edited by admin on Fri Dec 15 15:42:07 UTC 2023

Code System Code Type Description

EPA CompTox

DTXSID50165552

Created by admin on Fri Dec 15 15:42:07 UTC 2023 , Edited by admin on Fri Dec 15 15:42:07 UTC 2023

PRIMARY

INN

8079

Created by admin on Fri Dec 15 15:42:07 UTC 2023 , Edited by admin on Fri Dec 15 15:42:07 UTC 2023

PRIMARY

MESH

C116267

Created by admin on Fri Dec 15 15:42:07 UTC 2023 , Edited by admin on Fri Dec 15 15:42:07 UTC 2023

PRIMARY

CAS

154189-40-9

Created by admin on Fri Dec 15 15:42:07 UTC 2023 , Edited by admin on Fri Dec 15 15:42:07 UTC 2023

PRIMARY

FDA UNII

N32934RHGW

Created by admin on Fri Dec 15 15:42:07 UTC 2023 , Edited by admin on Fri Dec 15 15:42:07 UTC 2023

PRIMARY

PUBCHEM

183812

Created by admin on Fri Dec 15 15:42:07 UTC 2023 , Edited by admin on Fri Dec 15 15:42:07 UTC 2023

PRIMARY

NCI_THESAURUS

C76548

Created by admin on Fri Dec 15 15:42:07 UTC 2023 , Edited by admin on Fri Dec 15 15:42:07 UTC 2023

PRIMARY

SMS_ID

100000175532

Created by admin on Fri Dec 15 15:42:07 UTC 2023 , Edited by admin on Fri Dec 15 15:42:07 UTC 2023

PRIMARY

ChEMBL

CHEMBL82663

Created by admin on Fri Dec 15 15:42:07 UTC 2023 , Edited by admin on Fri Dec 15 15:42:07 UTC 2023

PRIMARY

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