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Details

Stereochemistry RACEMIC
Molecular Formula C21H27NO2
Molecular Weight 325.4446
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of WMS-1405

SMILES

COC1=CC=C2C(O)CN(CCCCC3=CC=CC=C3)CCC2=C1

InChI

InChIKey=NXWYICVCGHHJOR-UHFFFAOYSA-N
InChI=1S/C21H27NO2/c1-24-19-10-11-20-18(15-19)12-14-22(16-21(20)23)13-6-5-9-17-7-3-2-4-8-17/h2-4,7-8,10-11,15,21,23H,5-6,9,12-14,16H2,1H3

HIDE SMILES / InChI

Molecular Formula C21H27NO2
Molecular Weight 325.4446
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 20:00:25 GMT 2023
Edited
by admin
on Sat Dec 16 20:00:25 GMT 2023
Record UNII
MC34ZD3CB7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
WMS-1405
Code English
1H-3-Benzazepin-1-ol, 2,3,4,5-tetrahydro-7-methoxy-3-(4-phenylbutyl)-
Systematic Name English
Me-NB1
Common Name English
Code System Code Type Description
PUBCHEM
46845430
Created by admin on Sat Dec 16 20:00:25 GMT 2023 , Edited by admin on Sat Dec 16 20:00:25 GMT 2023
PRIMARY
FDA UNII
MC34ZD3CB7
Created by admin on Sat Dec 16 20:00:25 GMT 2023 , Edited by admin on Sat Dec 16 20:00:25 GMT 2023
PRIMARY
CAS
1232196-73-4
Created by admin on Sat Dec 16 20:00:25 GMT 2023 , Edited by admin on Sat Dec 16 20:00:25 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Ki
LABELED -> NON-LABELED