ABBOTT-40060

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H6F3N3
Molecular Weight	237.1806
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

FC(F)(F)C1=NN=C2N1C=CC3=C2C=CC=C3

InChI

InChIKey=VCCLTMGHQTUHGC-UHFFFAOYSA-N

InChI=1S/C11H6F3N3/c12-11(13,14)10-16-15-9-8-4-2-1-3-7(8)5-6-17(9)10/h1-6H

HIDE SMILES / InChI

Molecular Formula	C11H6F3N3
Molecular Weight	237.1806
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 `Mon Mar 31 17:51:48 GMT 2025` Edited by `admin` on `Mon Mar 31 17:51:48 GMT 2025`
Record UNII	RQ6VMJ9R7U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ABBOTT-40060

Code

English

NC-1140

Preferred Name

English

1,2,4-TRIAZOLO(3,4-A)ISOQUINOLINE, 3-(TRIFLUOROMETHYL)-

Systematic Name

English

S-TRIAZOLO(3,4-A)ISOQUINOLINE, 3-(TRIFLUOROMETHYL)-

Systematic Name

English

3-TRIFLUOROMETHYL-S-TRIAZOLO(3,4-A)ISOQUINOLINE

Systematic Name

English

Code System Code Type Description

FDA UNII

RQ6VMJ9R7U

Created by admin on Mon Mar 31 17:51:48 GMT 2025 , Edited by admin on Mon Mar 31 17:51:48 GMT 2025

PRIMARY

CAS

27022-50-0

Created by admin on Mon Mar 31 17:51:48 GMT 2025 , Edited by admin on Mon Mar 31 17:51:48 GMT 2025

PRIMARY

EPA CompTox

DTXSID50181510

Created by admin on Mon Mar 31 17:51:48 GMT 2025 , Edited by admin on Mon Mar 31 17:51:48 GMT 2025

PRIMARY

PUBCHEM

198063

Created by admin on Mon Mar 31 17:51:48 GMT 2025 , Edited by admin on Mon Mar 31 17:51:48 GMT 2025

PRIMARY