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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H11N3OS
Molecular Weight 257.311
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of M-62812 FREE BASE

SMILES

NC1=NSC2=C1C=CC(OC3=CC=CC=C3N)=C2

InChI

InChIKey=HQCTTYOADNAJJR-UHFFFAOYSA-N
InChI=1S/C13H11N3OS/c14-10-3-1-2-4-11(10)17-8-5-6-9-12(7-8)18-16-13(9)15/h1-7H,14H2,(H2,15,16)

HIDE SMILES / InChI

Molecular Formula C13H11N3OS
Molecular Weight 257.311
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Primary TargetPharmacologyConditionPotency
Substance Class Chemical
Record UNII
D98NBX7QJ5
Record Status Validated (UNII)
Record Version