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

Details

Stereochemistry ACHIRAL
Molecular Formula C10H10N2O4S
Molecular Weight 254.262
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of EDARAVONE SULFATE

SMILES

CC1=NN(C(OS(O)(=O)=O)=C1)C2=CC=CC=C2

InChI

InChIKey=LXFWRJDNDPUIAY-UHFFFAOYSA-N
InChI=1S/C10H10N2O4S/c1-8-7-10(16-17(13,14)15)12(11-8)9-5-3-2-4-6-9/h2-7H,1H3,(H,13,14,15)

HIDE SMILES / InChI

Molecular Formula C10H10N2O4S
Molecular Weight 254.262
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Oct 22 13:52:37 UTC 2019
Edited
by admin
on Tue Oct 22 13:52:37 UTC 2019
Record UNII
RQ9RYP03KR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
EDARAVONE SULFATE
Common Name English
MCI 186 SULFATE
Code English
1H-PYRAZOL-5-OL, 3-METHYL-1-PHENYL-, HYDROGEN SULFATE (ESTER)
Systematic Name English
1H-PYRAZOL-5-OL, 3-METHYL-1-PHENYL-, 5-(HYDROGEN SULFATE)
Systematic Name English
NORANTIPYRINE SULFATE
Common Name English
Code System Code Type Description
EPA CompTox
76407-98-2
Created by admin on Tue Oct 22 13:52:37 UTC 2019 , Edited by admin on Tue Oct 22 13:52:37 UTC 2019
PRIMARY
CAS
76407-98-2
Created by admin on Tue Oct 22 13:52:37 UTC 2019 , Edited by admin on Tue Oct 22 13:52:37 UTC 2019
PRIMARY
Related Record Type Details
TRANSPORTER -> SUBSTRATE
IN-VITRO
Km
Related Record Type Details
PARENT -> METABOLITE INACTIVE