INDRALIN

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C23H28O2S
Molecular Weight	368.532
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of INDRALIN

Structure Search

SMILES

C\C(=C/C1=CC=C(S1)C(O)=O)C2=C(C)C=C3C(=C2)C(C)(C)CCC3(C)C

InChI

InChIKey=QPAMXNZWXFZISY-SDNWHVSQSA-N

InChI=1S/C23H28O2S/c1-14(11-16-7-8-20(26-16)21(24)25)17-13-19-18(12-15(17)2)22(3,4)9-10-23(19,5)6/h7-8,11-13H,9-10H2,1-6H3,(H,24,25)/b14-11+

HIDE SMILES / InChI

Molecular Formula	C23H28O2S
Molecular Weight	368.532
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 `Tue Apr 01 23:04:55 GMT 2025` Edited by `admin` on `Tue Apr 01 23:04:55 GMT 2025`
Record UNII	ACF4F9H44I
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

INDRALIN

Common Name

English

AGN-191659

Preferred Name

English

2-THIOPHENECARBOXYLIC ACID, 5-((1E)-2-(5,6,7,8-TETRAHYDRO-3,5,5,8,8-PENTAMETHYL-2-NAPHTHALENYL)-1-PROPEN-1-YL)-

Systematic Name

English

5-((1E)-2-(5,6,7,8-TETRAHYDRO-3,5,5,8,8-PENTAMETHYL-2-NAPHTHALENYL)-1-PROPEN-1-YL)-2-THIOPHENECARBOXYLIC ACID

Systematic Name

English

INDRALINE

Common Name

English

Classification Tree Code System Code

FDA ORPHAN DRUG

636318

Created by admin on Tue Apr 01 23:04:55 GMT 2025 , Edited by admin on Tue Apr 01 23:04:55 GMT 2025

Code System Code Type Description

FDA UNII

ACF4F9H44I

Created by admin on Tue Apr 01 23:04:55 GMT 2025 , Edited by admin on Tue Apr 01 23:04:55 GMT 2025

PRIMARY

CAS

260243-35-4

Created by admin on Tue Apr 01 23:04:55 GMT 2025 , Edited by admin on Tue Apr 01 23:04:55 GMT 2025

NON-SPECIFIC STEREOCHEMISTRY

PUBCHEM

6366726

Created by admin on Tue Apr 01 23:04:55 GMT 2025 , Edited by admin on Tue Apr 01 23:04:55 GMT 2025

PRIMARY

CAS

156691-86-0

Created by admin on Tue Apr 01 23:04:55 GMT 2025 , Edited by admin on Tue Apr 01 23:04:55 GMT 2025

PRIMARY

CAS

156799-03-0

Created by admin on Tue Apr 01 23:04:55 GMT 2025 , Edited by admin on Tue Apr 01 23:04:55 GMT 2025

NO STRUCTURE GIVEN