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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H11NO2S
Molecular Weight 197.254
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(METHYLTHIO)ACETAMINOPHEN

SMILES

CSC1=C(O)C=CC(NC(C)=O)=C1

InChI

InChIKey=KNDKLDWGYWQCCJ-UHFFFAOYSA-N
InChI=1S/C9H11NO2S/c1-6(11)10-7-3-4-8(12)9(5-7)13-2/h3-5,12H,1-2H3,(H,10,11)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
3-(METHYLTHIO)ACETAMINOPHEN
Common Name English
METHYLTHIOACETAMINOPHEN
Common Name English
4'-HYDROXY-3'-(METHYLTHIO)ACETANILIDE
Systematic Name English
3-(METHYLTHIO)PARACETAMOL
Systematic Name English
ACETAMIDE, N-(4-HYDROXY-3-(METHYLTHIO)PHENYL)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID40190833
Created by admin on Fri Dec 15 19:13:04 GMT 2023 , Edited by admin on Fri Dec 15 19:13:04 GMT 2023
PRIMARY
CAS
37398-23-5
Created by admin on Fri Dec 15 19:13:04 GMT 2023 , Edited by admin on Fri Dec 15 19:13:04 GMT 2023
PRIMARY
FDA UNII
ZBY89Z1CWX
Created by admin on Fri Dec 15 19:13:04 GMT 2023 , Edited by admin on Fri Dec 15 19:13:04 GMT 2023
PRIMARY
PUBCHEM
162260
Created by admin on Fri Dec 15 19:13:04 GMT 2023 , Edited by admin on Fri Dec 15 19:13:04 GMT 2023
PRIMARY
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966