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Details

Stereochemistry RACEMIC
Molecular Formula C18H25ClN4O2
Molecular Weight 364.87
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-CHLORO-AB-PINACA, (±)-

SMILES

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

InChI

InChIKey=VUPMALPMUYUYES-UHFFFAOYSA-N
InChI=1S/C18H25ClN4O2/c1-12(2)15(17(20)24)21-18(25)16-13-8-4-5-9-14(13)23(22-16)11-7-3-6-10-19/h4-5,8-9,12,15H,3,6-7,10-11H2,1-2H3,(H2,20,24)(H,21,25)

HIDE SMILES / InChI

Molecular Formula C18H25ClN4O2
Molecular Weight 364.87
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 01:54:08 UTC 2023
Edited
by admin
on Sat Dec 16 01:54:08 UTC 2023
Record UNII
DX55R9D737
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-CHLORO-AB-PINACA, (±)-
Common Name English
5CL-AB-PINACA [NFLIS-DRUG]
Common Name English
2-((1-(5-CHLOROPENTYL)-1H-INDAZOL-3-YL)FORMAMIDO)-3-METHYLBUTANAMIDE
Systematic Name English
N-(1-AMINO-3-METHYL-1-OXOBUTAN-2-YL)-1-(5-CHLOROPENTYL)-1H-INDAZOLE-3-CARBOXAMIDE
Systematic Name English
1H-INDAZOLE-3-CARBOXAMIDE, N-(1-(AMINOCARBONYL)-2-METHYLPROPYL)-1-(5-CHLOROPENTYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
DX55R9D737
Created by admin on Sat Dec 16 01:54:08 UTC 2023 , Edited by admin on Sat Dec 16 01:54:08 UTC 2023
PRIMARY
PUBCHEM
119058051
Created by admin on Sat Dec 16 01:54:08 UTC 2023 , Edited by admin on Sat Dec 16 01:54:08 UTC 2023
PRIMARY
CAS
1863066-01-6
Created by admin on Sat Dec 16 01:54:08 UTC 2023 , Edited by admin on Sat Dec 16 01:54:08 UTC 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE