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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H26N4O2
Molecular Weight 378.4674
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ADB-PHETINACA

SMILES

CC(C)(C)[C@H](NC(=O)C1=NN(CCC2=CC=CC=C2)C3=CC=CC=C13)C(N)=O

InChI

InChIKey=GIUNLIQZFMBOGJ-LJQANCHMSA-N
InChI=1S/C22H26N4O2/c1-22(2,3)19(20(23)27)24-21(28)18-16-11-7-8-12-17(16)26(25-18)14-13-15-9-5-4-6-10-15/h4-12,19H,13-14H2,1-3H3,(H2,23,27)(H,24,28)/t19-/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H26N4O2
Molecular Weight 378.4674
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 18:09:29 UTC 2023
Edited
by admin
on Sat Dec 16 18:09:29 UTC 2023
Record UNII
ZV48MQ8R4L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ADB-PHETINACA
Common Name English
ADB-PHETINACA [NFLIS-DRUG]
Common Name English
(S)-N-(1-amino-3,3-dimethyl-1-oxobutan-2-yl)-1-phenethyl-1H-indazole-3-carboxamide
Systematic Name English
Code System Code Type Description
FDA UNII
ZV48MQ8R4L
Created by admin on Sat Dec 16 18:09:29 UTC 2023 , Edited by admin on Sat Dec 16 18:09:29 UTC 2023
PRIMARY
PUBCHEM
165365257
Created by admin on Sat Dec 16 18:09:29 UTC 2023 , Edited by admin on Sat Dec 16 18:09:29 UTC 2023
PRIMARY
CAYMAN
33194
Created by admin on Sat Dec 16 18:09:29 UTC 2023 , Edited by admin on Sat Dec 16 18:09:29 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
Related Record Type Details
ACTIVE MOIETY