U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C6H7F3N4.ClH
Molecular Weight 228.603
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(TRIFLUOROMETHYL)-5,6,7,8-TETRAHYDRO-(1,2,4)TRIAZOLO(4,3-A)PYRAZINE HYDROCHLORIDE

SMILES

Cl.FC(F)(F)C1=NN=C2CNCCN12

InChI

InChIKey=AQCSCRYRCRORET-UHFFFAOYSA-N
InChI=1S/C6H7F3N4.ClH/c7-6(8,9)5-12-11-4-3-10-1-2-13(4)5;/h10H,1-3H2;1H

HIDE SMILES / InChI

Molecular Formula C6H7F3N4
Molecular Weight 192.1418
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:33:40 GMT 2023
Edited
by admin
on Sat Dec 16 15:33:40 GMT 2023
Record UNII
Y0OF5KV5KA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(TRIFLUOROMETHYL)-5,6,7,8-TETRAHYDRO-(1,2,4)TRIAZOLO(4,3-A)PYRAZINE HYDROCHLORIDE
Common Name English
1,2,4-TRIAZOLO(4,3-A)PYRAZINE, 5,6,7,8-TETRAHYDRO-3-(TRIFLUOROMETHYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
Y0OF5KV5KA
Created by admin on Sat Dec 16 15:33:40 GMT 2023 , Edited by admin on Sat Dec 16 15:33:40 GMT 2023
PRIMARY
PUBCHEM
11961371
Created by admin on Sat Dec 16 15:33:40 GMT 2023 , Edited by admin on Sat Dec 16 15:33:40 GMT 2023
PRIMARY
EPA CompTox
DTXSID20474800
Created by admin on Sat Dec 16 15:33:40 GMT 2023 , Edited by admin on Sat Dec 16 15:33:40 GMT 2023
PRIMARY
CAS
762240-92-6
Created by admin on Sat Dec 16 15:33:40 GMT 2023 , Edited by admin on Sat Dec 16 15:33:40 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE