ELCUBRAGISTAT

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H22F9N3O2
Molecular Weight	507.3932
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

FC(F)(F)C(OC(=O)N1CCN(CC2=CC=C(C=C2N3CCCC3)C(F)(F)F)CC1)C(F)(F)F

InChI

InChIKey=SQZJGTOZFRNWCX-UHFFFAOYSA-N

InChI=1S/C20H22F9N3O2/c21-18(22,23)14-4-3-13(15(11-14)31-5-1-2-6-31)12-30-7-9-32(10-8-30)17(33)34-16(19(24,25)26)20(27,28)29/h3-4,11,16H,1-2,5-10,12H2

HIDE SMILES / InChI

Molecular Formula	C20H22F9N3O2
Molecular Weight	507.3932
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 `Sat Dec 16 15:11:51 UTC 2023` Edited by `admin` on `Sat Dec 16 15:11:51 UTC 2023`
Record UNII	FB39E94UXK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ELCUBRAGISTAT

Official Name

English

elcubragistat [INN]

Common Name

English

ABX1431

Code

English

1-PIPERAZINECARBOXYLIC ACID, 4-((2-(1-PYRROLIDINYL)-4-(TRIFLUOROMETHYL)PHENYL)METHYL)-2,2,2-TRIFLUORO-1-(TRIFLUOROMETHYL)ETHYL ESTER

Systematic Name

English

ABX-1431

Code

English

Code System Code Type Description

SMS_ID

300000042031