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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H22N4O2
Molecular Weight 314.3822
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ABO-4EN-PINACA

SMILES

CC[C@H](NC(=O)C1=NN(CCCC=C)C2=CC=CC=C12)C(N)=O

InChI

InChIKey=SHELRBQJCJWWQC-ZDUSSCGKSA-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)/t13-/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H22N4O2
Molecular Weight 314.3822
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 Sat Dec 16 18:57:39 GMT 2023
Edited
by admin
on Sat Dec 16 18:57:39 GMT 2023
Record UNII
D8TFV9M7H7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ABO-4EN-PINACA
Common Name English
ABO-4EN-PINACA, (S)
Common Name English
(S)-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
D8TFV9M7H7
Created by admin on Sat Dec 16 18:57:39 GMT 2023 , Edited by admin on Sat Dec 16 18:57:39 GMT 2023
PRIMARY
PUBCHEM
165365256
Created by admin on Sat Dec 16 18:57:39 GMT 2023 , Edited by admin on Sat Dec 16 18:57:39 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER
TARGET -> AGONIST
Related Record Type Details
ACTIVE MOIETY