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

Details

Stereochemistry ABSOLUTE
Molecular Formula C17H23FN2O
Molecular Weight 290.3757
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AZABUPERONE, (S)-

SMILES

[H][C@@]12CCCN1CCN(CCCC(=O)C3=CC=C(F)C=C3)C2

InChI

InChIKey=PQLYZHNINGGVMB-INIZCTEOSA-N
InChI=1S/C17H23FN2O/c18-15-7-5-14(6-8-15)17(21)4-2-9-19-11-12-20-10-1-3-16(20)13-19/h5-8,16H,1-4,9-13H2/t16-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
AZABUPERONE, (S)-
Common Name English
1-BUTANONE, 1-(4-FLUOROPHENYL)-4-(HEXAHYDROPYRROLO(1,2-A)PYRAZIN-2(1H)-YL), (S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
667420
Created by admin on Sat Dec 16 09:11:34 GMT 2023 , Edited by admin on Sat Dec 16 09:11:34 GMT 2023
PRIMARY
FDA UNII
WX783YBJ7A
Created by admin on Sat Dec 16 09:11:34 GMT 2023 , Edited by admin on Sat Dec 16 09:11:34 GMT 2023
PRIMARY