(2R,4S)-4-AMINO-N-((1R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHYL)-2-(4-FLUORO-2-METHYLPHENYL)-N-METHYL-1-PIPERIDINECARBOXAMIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H26F7N3O
Molecular Weight	505.4716
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (2R,4S)-4-AMINO-N-((1R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHYL)-2-(4-FLUORO-2-METHYLPHENYL)-N-METHYL-1-PIPERIDINECARBOXAMIDE

Structure Search

SMILES

C[C@@H](N(C)C(=O)N1CC[C@H](N)C[C@@H]1C2=CC=C(F)C=C2C)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChIKey=ZGILDIJYCXWGDR-XWRIVVANSA-N

InChI=1S/C24H26F7N3O/c1-13-8-18(25)4-5-20(13)21-12-19(32)6-7-34(21)22(35)33(3)14(2)15-9-16(23(26,27)28)11-17(10-15)24(29,30)31/h4-5,8-11,14,19,21H,6-7,12,32H2,1-3H3/t14-,19+,21-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H26F7N3O
Molecular Weight	505.4716
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 06:13:40 GMT 2025` Edited by `admin` on `Wed Apr 02 06:13:40 GMT 2025`
Record UNII	DW2FZ8F3ZE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(2R,4S)-4-AMINO-N-((1R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHYL)-2-(4-FLUORO-2-METHYLPHENYL)-N-METHYL-1-PIPERIDINECARBOXAMIDE

Systematic Name

English

GSK 2110277

Preferred Name

English

GSK2110277

Code

English

1-PIPERIDINECARBOXAMIDE, 4-AMINO-N-((1R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHYL)-2-(4-FLUORO-2-METHYLPHENYL)-N-METHYL-, (2R,4S)-

Systematic Name

English

CASOPITANT METABOLITE M134

Common Name

English

Code System Code Type Description

PUBCHEM

57939522

Created by admin on Wed Apr 02 06:13:40 GMT 2025 , Edited by admin on Wed Apr 02 06:13:40 GMT 2025

PRIMARY

FDA UNII

DW2FZ8F3ZE

Created by admin on Wed Apr 02 06:13:40 GMT 2025 , Edited by admin on Wed Apr 02 06:13:40 GMT 2025

PRIMARY

CAS

629930-11-6

Created by admin on Wed Apr 02 06:13:40 GMT 2025 , Edited by admin on Wed Apr 02 06:13:40 GMT 2025

PRIMARY

Related Record Type Details


					3B03KPM27L

CASOPITANT

PARENT -> METABOLITE

Qualification:

FECAL; PLASMA

Amount: