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Details

Stereochemistry ACHIRAL
Molecular Formula C11H14BrNOS
Molecular Weight 288.204
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Bromo-4-(2-methylpropoxy)benzenecarbothioamide

SMILES

CC(C)COC1=CC=C(C=C1Br)C(N)=S

InChI

InChIKey=FLDZQWXTSSWIAK-UHFFFAOYSA-N
InChI=1S/C11H14BrNOS/c1-7(2)6-14-10-4-3-8(11(13)15)5-9(10)12/h3-5,7H,6H2,1-2H3,(H2,13,15)

HIDE SMILES / InChI

Molecular Formula C11H14BrNOS
Molecular Weight 288.204
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 Wed Apr 02 18:40:36 GMT 2025
Edited
by admin
on Wed Apr 02 18:40:36 GMT 2025
Record UNII
R7BWR4GS2A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Bromo-4-isobutoxybenzothioamide
Preferred Name English
3-Bromo-4-(2-methylpropoxy)benzenecarbothioamide
Systematic Name English
Benzenecarbothioamide, 3-bromo-4-(2-methylpropoxy)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID00451033
Created by admin on Wed Apr 02 18:40:36 GMT 2025 , Edited by admin on Wed Apr 02 18:40:36 GMT 2025
PRIMARY
FDA UNII
R7BWR4GS2A
Created by admin on Wed Apr 02 18:40:36 GMT 2025 , Edited by admin on Wed Apr 02 18:40:36 GMT 2025
PRIMARY
PUBCHEM
10989834
Created by admin on Wed Apr 02 18:40:36 GMT 2025 , Edited by admin on Wed Apr 02 18:40:36 GMT 2025
PRIMARY
CAS
208665-96-7
Created by admin on Wed Apr 02 18:40:36 GMT 2025 , Edited by admin on Wed Apr 02 18:40:36 GMT 2025
PRIMARY