Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C16H16F5N5O |
| Molecular Weight | 389.3232 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
N[C@@H](CC(=O)N1CCN2C(C1)=NN=C2C(F)(F)F)CC3=CC=C(F)C(F)=C3
InChI
InChIKey=VZQYRRVZSLWCAA-SNVBAGLBSA-N
InChI=1S/C16H16F5N5O/c17-11-2-1-9(6-12(11)18)5-10(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,6,10H,3-5,7-8,22H2/t10-/m1/s1
| Molecular Formula | C16H16F5N5O |
| Molecular Weight | 389.3232 |
| 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
Edited
Wed Apr 02 17:30:51 GMT 2025
by
admin
on
Wed Apr 02 17:30:51 GMT 2025
|
| Record UNII |
QHD8RD5DCQ
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Preferred Name | English | ||
|
Systematic Name | English | ||
|
Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
QHD8RD5DCQ
Created by
admin on Wed Apr 02 17:30:51 GMT 2025 , Edited by admin on Wed Apr 02 17:30:51 GMT 2025
|
PRIMARY | |||
|
486459-88-5
Created by
admin on Wed Apr 02 17:30:51 GMT 2025 , Edited by admin on Wed Apr 02 17:30:51 GMT 2025
|
PRIMARY | |||
|
10157141
Created by
admin on Wed Apr 02 17:30:51 GMT 2025 , Edited by admin on Wed Apr 02 17:30:51 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
RACEMATE -> ENANTIOMER |
|
![Structure of 3-Amino-4-(3,4-difluorophenyl)-1-[5,6-dihydro-3-(trifluoromethyl)-1,2,4-triazolo[4,3-a]pyrazin-7(8H)-yl]-1-butanone](/img/121633f1-b158-4d1f-ba10-2665744c69e6.svg "Structure of 3-Amino-4-(3,4-difluorophenyl)-1-[5,6-dihydro-3-(trifluoromethyl)-1,2,4-triazolo[4,3-a]pyrazin-7(8H)-yl]-1-butanone")