ATIBEPRONE

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

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H18N2O3S
Molecular Weight	330.401
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ATIBEPRONE

Structure Search

SMILES

CC(C)C1=NN=C(COC2=CC3=C(C=C2)C(C)=C(C)C(=O)O3)S1

InChI

InChIKey=HQTNJPCZUQAYAB-UHFFFAOYSA-N

InChI=1S/C17H18N2O3S/c1-9(2)16-19-18-15(23-16)8-21-12-5-6-13-10(3)11(4)17(20)22-14(13)7-12/h5-7,9H,8H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C17H18N2O3S
Molecular Weight	330.401
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Description
Sources: https://worldwide.espacenet.com/publicationDetails/biblio?DB=EPODOC&II=0&ND=3&adjacent=true&locale=en_EP&FT=D&date=19940427&CC=EP&NR=0594036A1&KC=A1 | https://worldwide.espacenet.com/publicationDetails/biblio?DB=EPODOC&II=0&ND=3&adjacent=true&locale=en_EP&FT=D&date=19941124&CC=DE&NR=4316537A1&KC=A1

Atibeprone is an antidepressant which was developed in the mid-1990s, but was never marketed.

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:40:13 GMT 2023` Edited by `admin` on `Fri Dec 15 15:40:13 GMT 2023`
Record UNII	PZV3P03F1U
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ATIBEPRONE

Official Name

English

7-((5-ISOPROPYL-1,3,4-THIADIAZOL-2-YL)METHOXY)-3,4-DIMETHYLCOUMARIN

Systematic Name

English

LU-53439

Code

English

LU53439

Code

English

atibeprone [INN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C265

Created by admin on Fri Dec 15 15:40:13 GMT 2023 , Edited by admin on Fri Dec 15 15:40:13 GMT 2023

Code System Code Type Description

INN

7293

Created by admin on Fri Dec 15 15:40:13 GMT 2023 , Edited by admin on Fri Dec 15 15:40:13 GMT 2023

PRIMARY

CAS

153420-96-3

Created by admin on Fri Dec 15 15:40:13 GMT 2023 , Edited by admin on Fri Dec 15 15:40:13 GMT 2023

PRIMARY

FDA UNII

PZV3P03F1U

Created by admin on Fri Dec 15 15:40:13 GMT 2023 , Edited by admin on Fri Dec 15 15:40:13 GMT 2023

PRIMARY

PUBCHEM

179342

Created by admin on Fri Dec 15 15:40:13 GMT 2023 , Edited by admin on Fri Dec 15 15:40:13 GMT 2023

PRIMARY

SMS_ID

100000086632

Created by admin on Fri Dec 15 15:40:13 GMT 2023 , Edited by admin on Fri Dec 15 15:40:13 GMT 2023

PRIMARY

EPA CompTox

DTXSID00165325

Created by admin on Fri Dec 15 15:40:13 GMT 2023 , Edited by admin on Fri Dec 15 15:40:13 GMT 2023

PRIMARY

WIKIPEDIA

Atibeprone

Created by admin on Fri Dec 15 15:40:13 GMT 2023 , Edited by admin on Fri Dec 15 15:40:13 GMT 2023

PRIMARY

EVMPD

SUB05593MIG

Created by admin on Fri Dec 15 15:40:13 GMT 2023 , Edited by admin on Fri Dec 15 15:40:13 GMT 2023

PRIMARY

ChEMBL

CHEMBL19004

Created by admin on Fri Dec 15 15:40:13 GMT 2023 , Edited by admin on Fri Dec 15 15:40:13 GMT 2023

PRIMARY

NCI_THESAURUS

C72707

Created by admin on Fri Dec 15 15:40:13 GMT 2023 , Edited by admin on Fri Dec 15 15:40:13 GMT 2023

PRIMARY

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