tert-Butyl ((R)-4-oxo-4-(((R)-4-oxo-4-(3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl)-1-(2,4,5-trifluorophenyl)butan-2-yl)amino)-1-(2,4,5-trifluorophenyl)butan-2-yl)carbamate

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H31F9N6O4
Molecular Weight	722.6013
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of tert-Butyl ((R)-4-oxo-4-(((R)-4-oxo-4-(3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl)-1-(2,4,5-trifluorophenyl)butan-2-yl)amino)-1-(2,4,5-trifluorophenyl)butan-2-yl)carbamate

Structure Search

SMILES

CC(C)(C)OC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N1CCN2C(C1)=NN=C2C(F)(F)F)CC3=C(F)C=C(F)C(F)=C3)CC4=C(F)C=C(F)C(F)=C4

InChI

InChIKey=ZPWWGTPYIACDPL-QZTJIDSGSA-N

InChI=1S/C31H31F9N6O4/c1-30(2,3)50-29(49)42-17(6-15-8-21(34)23(36)12-19(15)32)10-26(47)41-18(7-16-9-22(35)24(37)13-20(16)33)11-27(48)45-4-5-46-25(14-45)43-44-28(46)31(38,39)40/h8-9,12-13,17-18H,4-7,10-11,14H2,1-3H3,(H,41,47)(H,42,49)/t17-,18-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C31H31F9N6O4
Molecular Weight	722.6013
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:30:54 GMT 2025` Edited by `admin` on `Wed Apr 02 17:30:54 GMT 2025`
Record UNII	7Z4YZ4T3V2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,1-Dimethylethyl N-[(1R)-3-[[(1R)-3-[5,6-dihydro-3-(trifluoromethyl)-1,2,4-triazolo[4,3-a]pyrazin-7(8H)-yl]-3-oxo-1-[(2,4,5-trifluorophenyl)methyl]propyl]amino]-3-oxo-1-[(2,4,5-trifluorophenyl)methyl]propyl]carbamate

Preferred Name

English

tert-Butyl ((R)-4-oxo-4-(((R)-4-oxo-4-(3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl)-1-(2,4,5-trifluorophenyl)butan-2-yl)amino)-1-(2,4,5-trifluorophenyl)butan-2-yl)carbamate

Systematic Name

English

Code System Code Type Description

PUBCHEM

169434156

Created by admin on Wed Apr 02 17:30:54 GMT 2025 , Edited by admin on Wed Apr 02 17:30:54 GMT 2025

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CAS

2088771-62-2

Created by admin on Wed Apr 02 17:30:54 GMT 2025 , Edited by admin on Wed Apr 02 17:30:54 GMT 2025

PRIMARY

FDA UNII

7Z4YZ4T3V2

Created by admin on Wed Apr 02 17:30:54 GMT 2025 , Edited by admin on Wed Apr 02 17:30:54 GMT 2025

PRIMARY