Sitagliptin keto amide

Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H12F6N4O2
Molecular Weight	406.2825
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

FC1=CC(F)=C(F)C=C1CC(=O)CC(=O)N2CCN3C(C2)=NN=C3C(F)(F)F

InChI

InChIKey=QAEDTLFWHIEVPK-UHFFFAOYSA-N

InChI=1S/C16H12F6N4O2/c17-10-6-12(19)11(18)4-8(10)3-9(27)5-14(28)25-1-2-26-13(7-25)23-24-15(26)16(20,21)22/h4,6H,1-3,5,7H2

HIDE SMILES / InChI

Approval Year

Name

Type

Language

Sitagliptin keto amide

Common Name

English

1,3-BUTANEDIONE, 1-(5,6-DIHYDRO-3-(TRIFLUOROMETHYL)-1,2,4-TRIAZOLO(4,3-A)PYRAZIN-7(8H)-YL)-4-(2,4,5-TRIFLUOROPHENYL)-

Preferred Name

English

SITAGLIPTIN KETO AMIDE IMPURITY

Common Name

English

PROSITAGLIPTIN KETONE

Common Name

English

7-(1,3-DIOXO-4-(2,4,5-TRIFLUOROPHENYL)BUTYL)-3-TRIFLUOROMETHYL-5,6,7,8-TETRAHYDRO-1,2,4-TRIAZOLO(4,3-A)PYRAZINE

Common Name

English

1-(3-(TRIFLUOROMETHYL)-5,6-DIHYDRO-(1,2,4)TRIAZOLO(4,3-A)PYRAZIN-7(8H)-YL)-4-(2,4,5-TRIFLUOROPHENYL)BUTANE-1,3-DIONE

Systematic Name

English

Code System Code Type Description

PUBCHEM

9887588

Created by admin on Wed Apr 02 13:03:30 GMT 2025 , Edited by admin on Wed Apr 02 13:03:30 GMT 2025

PRIMARY

FDA UNII

CZZ5UJ9MJ6

Created by admin on Wed Apr 02 13:03:30 GMT 2025 , Edited by admin on Wed Apr 02 13:03:30 GMT 2025

PRIMARY

CAS

764667-65-4

Created by admin on Wed Apr 02 13:03:30 GMT 2025 , Edited by admin on Wed Apr 02 13:03:30 GMT 2025

PRIMARY

EPA CompTox

DTXSID50432418

Created by admin on Wed Apr 02 13:03:30 GMT 2025 , Edited by admin on Wed Apr 02 13:03:30 GMT 2025

PRIMARY

SUBSTANCE RECORD


					CZZ5UJ9MJ6

Sitagliptin keto amide