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Details

Stereochemistry RACEMIC
Molecular Formula C7H14BrNO
Molecular Weight 208.096
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ibrotamide

SMILES

CCC(Br)(C(C)C)C(N)=O

InChI

InChIKey=YQZUCYWIGWXZQO-UHFFFAOYSA-N
InChI=1S/C7H14BrNO/c1-4-7(8,5(2)3)6(9)10/h5H,4H2,1-3H3,(H2,9,10)

HIDE SMILES / InChI

Molecular Formula C7H14BrNO
Molecular Weight 208.096
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Substance Class Chemical
Created
by admin
on Mon Mar 31 18:00:59 GMT 2025
Edited
by admin
on Mon Mar 31 18:00:59 GMT 2025
Record UNII
09C8B34RDF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ibrotamide
INN  
INN  
Official Name English
ibrotamide [INN]
Preferred Name English
2-Bromo-2-ethylisovaleramide
Systematic Name English
BUTANAMIDE, 2-BROMO-2-ETHYL-3-METHYL-
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C29756
Created by admin on Mon Mar 31 18:00:59 GMT 2025 , Edited by admin on Mon Mar 31 18:00:59 GMT 2025
Code System Code Type Description
INN
180
Created by admin on Mon Mar 31 18:00:59 GMT 2025 , Edited by admin on Mon Mar 31 18:00:59 GMT 2025
PRIMARY
NCI_THESAURUS
C83773
Created by admin on Mon Mar 31 18:00:59 GMT 2025 , Edited by admin on Mon Mar 31 18:00:59 GMT 2025
PRIMARY
EPA CompTox
DTXSID80861954
Created by admin on Mon Mar 31 18:00:59 GMT 2025 , Edited by admin on Mon Mar 31 18:00:59 GMT 2025
PRIMARY
FDA UNII
09C8B34RDF
Created by admin on Mon Mar 31 18:00:59 GMT 2025 , Edited by admin on Mon Mar 31 18:00:59 GMT 2025
PRIMARY
SMS_ID
100000083647
Created by admin on Mon Mar 31 18:00:59 GMT 2025 , Edited by admin on Mon Mar 31 18:00:59 GMT 2025
PRIMARY
CAS
466-14-8
Created by admin on Mon Mar 31 18:00:59 GMT 2025 , Edited by admin on Mon Mar 31 18:00:59 GMT 2025
PRIMARY
PUBCHEM
216287
Created by admin on Mon Mar 31 18:00:59 GMT 2025 , Edited by admin on Mon Mar 31 18:00:59 GMT 2025
PRIMARY
ChEMBL
CHEMBL2103967
Created by admin on Mon Mar 31 18:00:59 GMT 2025 , Edited by admin on Mon Mar 31 18:00:59 GMT 2025
PRIMARY
EVMPD
SUB08095MIG
Created by admin on Mon Mar 31 18:00:59 GMT 2025 , Edited by admin on Mon Mar 31 18:00:59 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY