ATRELEUTON

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H15FN2O2S
Molecular Weight	318.366
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ATRELEUTON

Structure Search

SMILES

C[C@H](C#CC1=CC=C(CC2=CC=C(F)C=C2)S1)N(O)C(N)=O

InChI

InChIKey=MMSNEKOTSJRTRI-LLVKDONJSA-N

InChI=1S/C16H15FN2O2S/c1-11(19(21)16(18)20)2-7-14-8-9-15(22-14)10-12-3-5-13(17)6-4-12/h3-6,8-9,11,21H,10H2,1H3,(H2,18,20)/t11-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C16H15FN2O2S
Molecular Weight	318.366
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:21:30 UTC 2023` Edited by `admin` on `Sat Dec 16 16:21:30 UTC 2023`
Record UNII	U301T88E1M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ATRELEUTON

Official Name

English

ABBOTT-85761

Code

English

(R)-N-(3-(5-(4-FLUOROBENZYL) THIEN-2-YL)-1-METHYL-2-PROPYN- YL)-N-HYDROXY-UREA

Systematic Name

English

A-85761

Code

English

ATRELEUTON [USAN]

Common Name

English

ABT-761

Code

English

atreleuton [INN]

Common Name

English

Atreleuton [WHO-DD]

Common Name

English

VIA-2291

Code

English

A-85761.0

Code

English

1-((R)-3-(5-(P-FLUOROBENZYL)-2-THIENYL)-1-METHYL-2-PROPYNYL)-1-HYDROXYUREA

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C1322

Created by admin on Sat Dec 16 16:21:30 UTC 2023 , Edited by admin on Sat Dec 16 16:21:30 UTC 2023

Code System Code Type Description

INN

7667

Created by admin on Sat Dec 16 16:21:30 UTC 2023 , Edited by admin on Sat Dec 16 16:21:30 UTC 2023

PRIMARY

EVMPD

SUB05604MIG

Created by admin on Sat Dec 16 16:21:30 UTC 2023 , Edited by admin on Sat Dec 16 16:21:30 UTC 2023

PRIMARY

CAS

154355-76-7

Created by admin on Sat Dec 16 16:21:30 UTC 2023 , Edited by admin on Sat Dec 16 16:21:30 UTC 2023

PRIMARY

DRUG BANK

DB12758

Created by admin on Sat Dec 16 16:21:30 UTC 2023 , Edited by admin on Sat Dec 16 16:21:30 UTC 2023

PRIMARY

FDA UNII

U301T88E1M

Created by admin on Sat Dec 16 16:21:30 UTC 2023 , Edited by admin on Sat Dec 16 16:21:30 UTC 2023

PRIMARY

PUBCHEM

3086671

Created by admin on Sat Dec 16 16:21:30 UTC 2023 , Edited by admin on Sat Dec 16 16:21:30 UTC 2023

PRIMARY

EPA CompTox

DTXSID10165598

Created by admin on Sat Dec 16 16:21:30 UTC 2023 , Edited by admin on Sat Dec 16 16:21:30 UTC 2023

PRIMARY

SMS_ID

100000086656

Created by admin on Sat Dec 16 16:21:30 UTC 2023 , Edited by admin on Sat Dec 16 16:21:30 UTC 2023

PRIMARY

NCI_THESAURUS

C64176

Created by admin on Sat Dec 16 16:21:30 UTC 2023 , Edited by admin on Sat Dec 16 16:21:30 UTC 2023

PRIMARY

USAN

JJ-03

Created by admin on Sat Dec 16 16:21:30 UTC 2023 , Edited by admin on Sat Dec 16 16:21:30 UTC 2023

PRIMARY

ChEMBL

CHEMBL59356

Created by admin on Sat Dec 16 16:21:30 UTC 2023 , Edited by admin on Sat Dec 16 16:21:30 UTC 2023

PRIMARY

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ACTIVE MOIETY

Amount: