Darbinurad

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H16N2O2S
Molecular Weight	324.397
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Darbinurad

Structure Search

SMILES

OC(=O)CC3(CSC1=CC=NC=C1C2=CC=C(C=C2)C#N)CC3

InChI

InChIKey=RHASGUGQMCVYMQ-UHFFFAOYSA-N

InChI=1S/C18H16N2O2S/c19-10-13-1-3-14(4-2-13)15-11-20-8-5-16(15)23-12-18(6-7-18)9-17(21)22/h1-5,8,11H,6-7,9,12H2,(H,21,22)

HIDE SMILES / InChI

Molecular Formula	C18H16N2O2S
Molecular Weight	324.397
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 `Tue Apr 01 21:23:40 GMT 2025` Edited by `admin` on `Tue Apr 01 21:23:40 GMT 2025`
Record UNII	AYFFM7L5F0
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Darbinurad

Official Name

English

darbinurad [INN]

Preferred Name

English

Cyclopropaneacetic acid, 1-[[[3-(4-cyanophenyl)-4-pyridinyl]thio]methyl]-

Systematic Name

English

1-[[[3-(4-Cyanophenyl)-4-pyridinyl]thio]methyl]cyclopropaneacetic acid

Systematic Name

English

Code System Code Type Description

SMS_ID

300000054566

Created by admin on Tue Apr 01 21:23:40 GMT 2025 , Edited by admin on Tue Apr 01 21:23:40 GMT 2025

PRIMARY

PUBCHEM

118902135

Created by admin on Tue Apr 01 21:23:40 GMT 2025 , Edited by admin on Tue Apr 01 21:23:40 GMT 2025

PRIMARY

NCI_THESAURUS

C206898

Created by admin on Tue Apr 01 21:23:40 GMT 2025 , Edited by admin on Tue Apr 01 21:23:40 GMT 2025

PRIMARY

FDA UNII

AYFFM7L5F0

Created by admin on Tue Apr 01 21:23:40 GMT 2025 , Edited by admin on Tue Apr 01 21:23:40 GMT 2025

PRIMARY

CAS

1877347-38-0

Created by admin on Tue Apr 01 21:23:40 GMT 2025 , Edited by admin on Tue Apr 01 21:23:40 GMT 2025

PRIMARY

INN

12861

Created by admin on Tue Apr 01 21:23:40 GMT 2025 , Edited by admin on Tue Apr 01 21:23:40 GMT 2025

PRIMARY

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