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Details

Stereochemistry ACHIRAL
Molecular Formula C21H23N3O
Molecular Weight 333.4268
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of BJB-432

SMILES

CC1=C(CCNCC2=CC=C(\C=C\C(N)=O)C=C2)C3=C(N1)C=CC=C3

InChI

InChIKey=VOZMMIFGJRFSNT-ZHACJKMWSA-N
InChI=1S/C21H23N3O/c1-15-18(19-4-2-3-5-20(19)24-15)12-13-23-14-17-8-6-16(7-9-17)10-11-21(22)25/h2-11,23-24H,12-14H2,1H3,(H2,22,25)/b11-10+

HIDE SMILES / InChI

Molecular Formula C21H23N3O
Molecular Weight 333.4268
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 23:15:59 UTC 2023
Edited
by admin
on Thu Jul 06 23:15:59 UTC 2023
Record UNII
Y1FUG6Z8KL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BJB-432
Code English
(2E)-3-(4-(((2-(2-METHYL-1H-INDOL-3-YL)ETHYL)AMINO)METHYL)PHENYL)-2-PROPENAMIDE
Systematic Name English
PANOBINOSTAT METABOLITE M37.8
Common Name English
2-PROPENAMIDE, 3-(4-(((2-(2-METHYL-1H-INDOL-3-YL)ETHYL)AMINO)METHYL)PHENYL)-, (2E)-
Systematic Name English
BJB432
Code English
Code System Code Type Description
FDA UNII
Y1FUG6Z8KL
Created by admin on Thu Jul 06 23:15:59 UTC 2023 , Edited by admin on Thu Jul 06 23:15:59 UTC 2023
PRIMARY
PUBCHEM
24888322
Created by admin on Thu Jul 06 23:15:59 UTC 2023 , Edited by admin on Thu Jul 06 23:15:59 UTC 2023
PRIMARY
CAS
960058-94-0
Created by admin on Thu Jul 06 23:15:59 UTC 2023 , Edited by admin on Thu Jul 06 23:15:59 UTC 2023
PRIMARY
Related Record Type Details
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