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Details

Stereochemistry RACEMIC
Molecular Formula C17H22N4O2
Molecular Weight 314.3822
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ABO-4EN-PINACA, (±)-

SMILES

CCC(NC(=O)C1=NN(CCCC=C)C2=CC=CC=C12)C(N)=O

InChI

InChIKey=SHELRBQJCJWWQC-UHFFFAOYSA-N
InChI=1S/C17H22N4O2/c1-3-5-8-11-21-14-10-7-6-9-12(14)15(20-21)17(23)19-13(4-2)16(18)22/h3,6-7,9-10,13H,1,4-5,8,11H2,2H3,(H2,18,22)(H,19,23)

HIDE SMILES / InChI

Molecular Formula C17H22N4O2
Molecular Weight 314.3822
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:43:37 GMT 2023
Edited
by admin
on Sat Dec 16 18:43:37 GMT 2023
Record UNII
EJ6L4KQY33
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ABO-4EN-PINACA, (±)-
Common Name English
1H-INDAZOLE-3-CARBOXAMIDE, N-1-(AMINOCARBONYL)-2-METHYLPROPYL)-1-(4-PENTEN-1-YL)-
Systematic Name English
N-(1-AMINO-1-OXOBUTAN-2-YL)-1-(PENT-4-EN-1-YL)-1H-INDAZOLE-3-CARBOXAMIDE
Systematic Name English
Code System Code Type Description
FDA UNII
EJ6L4KQY33
Created by admin on Sat Dec 16 18:43:38 GMT 2023 , Edited by admin on Sat Dec 16 18:43:38 GMT 2023
PRIMARY
PUBCHEM
162705327
Created by admin on Sat Dec 16 18:43:38 GMT 2023 , Edited by admin on Sat Dec 16 18:43:38 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
ENANTIOMER -> RACEMATE
Related Record Type Details
ACTIVE MOIETY