U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

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=C(Br)C=C(C=C1)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

Approval Year

Name Type Language
3-Bromo-4-(2-methylpropoxy)benzenecarbothioamide
Systematic Name English
3-Bromo-4-isobutoxybenzothioamide
Systematic Name English
Benzenecarbothioamide, 3-bromo-4-(2-methylpropoxy)-
Systematic Name English
Code System Code Type Description
FDA UNII
R7BWR4GS2A
Created by admin on Sat Dec 16 20:12:31 GMT 2023 , Edited by admin on Sat Dec 16 20:12:31 GMT 2023
PRIMARY
PUBCHEM
10989834
Created by admin on Sat Dec 16 20:12:31 GMT 2023 , Edited by admin on Sat Dec 16 20:12:31 GMT 2023
PRIMARY
CAS
208665-96-7
Created by admin on Sat Dec 16 20:12:31 GMT 2023 , Edited by admin on Sat Dec 16 20:12:31 GMT 2023
PRIMARY