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

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H23F6N5O3
Molecular Weight	507.4294
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

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

Structure Search

SMILES

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

InChI

InChIKey=RHCVXZBZEKGRQP-LBPRGKRZSA-N

InChI=1S/C21H23F6N5O3/c1-20(2,3)35-19(34)28-12(6-11-7-14(23)15(24)9-13(11)22)8-17(33)31-4-5-32-16(10-31)29-30-18(32)21(25,26)27/h7,9,12H,4-6,8,10H2,1-3H3,(H,28,34)/t12-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H23F6N5O3
Molecular Weight	507.4294
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 19:36:37 GMT 2025` Edited by `admin` on `Wed Apr 02 19:36:37 GMT 2025`
Record UNII	U3UTD56KME
Record Status	`Validated (UNII)`
Record Version

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Language

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

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English

Code System Code Type Description

FDA UNII

U3UTD56KME

Created by admin on Wed Apr 02 19:36:37 GMT 2025 , Edited by admin on Wed Apr 02 19:36:37 GMT 2025

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PUBCHEM

124604238

Created by admin on Wed Apr 02 19:36:37 GMT 2025 , Edited by admin on Wed Apr 02 19:36:37 GMT 2025

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