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Details

Stereochemistry ACHIRAL
Molecular Formula C24H24FN3O2
Molecular Weight 405.4647
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ADOPRAZINE

SMILES

FC1=CC=C(C=C1)C2=CN=CC(CN3CCN(CC3)C4=CC=CC5=C4OCCO5)=C2

InChI

InChIKey=IUVSEUFHPNITEQ-UHFFFAOYSA-N
InChI=1S/C24H24FN3O2/c25-21-6-4-19(5-7-21)20-14-18(15-26-16-20)17-27-8-10-28(11-9-27)22-2-1-3-23-24(22)30-13-12-29-23/h1-7,14-16H,8-13,17H2

HIDE SMILES / InChI

Molecular Formula C24H24FN3O2
Molecular Weight 405.4647
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:10:36 UTC 2023
Edited
by admin
on Fri Dec 15 16:10:36 UTC 2023
Record UNII
7SNB18Q89D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ADOPRAZINE
INN   WHO-DD  
INN  
Official Name English
1-(2,3-DIHYDRO-1,4-BENZODIOXIN-5-YL)-4-((5-(4-FLUOROPHENYL)PYRIDIN-3-YL)METHYL)PIPERAZINE
Systematic Name English
Adoprazine [WHO-DD]
Common Name English
adoprazine [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C265
Created by admin on Fri Dec 15 16:10:36 UTC 2023 , Edited by admin on Fri Dec 15 16:10:36 UTC 2023
Code System Code Type Description
FDA UNII
7SNB18Q89D
Created by admin on Fri Dec 15 16:10:36 UTC 2023 , Edited by admin on Fri Dec 15 16:10:36 UTC 2023
PRIMARY
SMS_ID
300000037041
Created by admin on Fri Dec 15 16:10:36 UTC 2023 , Edited by admin on Fri Dec 15 16:10:36 UTC 2023
PRIMARY
INN
8980
Created by admin on Fri Dec 15 16:10:36 UTC 2023 , Edited by admin on Fri Dec 15 16:10:36 UTC 2023
PRIMARY
PUBCHEM
9887537
Created by admin on Fri Dec 15 16:10:36 UTC 2023 , Edited by admin on Fri Dec 15 16:10:36 UTC 2023
PRIMARY
CAS
222551-17-9
Created by admin on Fri Dec 15 16:10:36 UTC 2023 , Edited by admin on Fri Dec 15 16:10:36 UTC 2023
PRIMARY
EPA CompTox
DTXSID40944914
Created by admin on Fri Dec 15 16:10:36 UTC 2023 , Edited by admin on Fri Dec 15 16:10:36 UTC 2023
PRIMARY
NCI_THESAURUS
C81482
Created by admin on Fri Dec 15 16:10:36 UTC 2023 , Edited by admin on Fri Dec 15 16:10:36 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
TARGET -> INHIBITOR
TARGET -> AGONIST
SALT/SOLVATE -> PARENT
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ACTIVE MOIETY