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

Details

Stereochemistry ACHIRAL
Molecular Formula C10H9N3S
Molecular Weight 203.264
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5,7-DIMETHYL(1,2,4)TRIAZOLO(3,4-B)(1,3)BENZOTHIAZOLE

SMILES

CC1=CC2=C(N3C=NN=C3S2)C(C)=C1

InChI

InChIKey=OSXXJJFPJYFCPT-UHFFFAOYSA-N
InChI=1S/C10H9N3S/c1-6-3-7(2)9-8(4-6)14-10-12-11-5-13(9)10/h3-5H,1-2H3

HIDE SMILES / InChI

Molecular Formula C10H9N3S
Molecular Weight 203.264
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 Tue Apr 01 19:50:01 GMT 2025
Edited
by admin
on Tue Apr 01 19:50:01 GMT 2025
Record UNII
G6GU7GHZ98
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-295709
Preferred Name English
5,7-DIMETHYL(1,2,4)TRIAZOLO(3,4-B)(1,3)BENZOTHIAZOLE
Systematic Name English
1,2,4-TRIAZOLO(3,4-B)BENZOTHIAZOLE, 5,7-DIMETHYL-
Systematic Name English
5,7-DIMETHYL-1,2,4-TRIAZOLO(3,4-B)BENZOTHIAZOLE
Systematic Name English
5,7-DIMETHYL-S-TRIAZOLO(3,4-B)BENZOTHIAZOLE
Systematic Name English
Code System Code Type Description
CAS
68925-82-6
Created by admin on Tue Apr 01 19:50:01 GMT 2025 , Edited by admin on Tue Apr 01 19:50:01 GMT 2025
PRIMARY
PUBCHEM
326031
Created by admin on Tue Apr 01 19:50:01 GMT 2025 , Edited by admin on Tue Apr 01 19:50:01 GMT 2025
PRIMARY
EPA CompTox
DTXSID50218996
Created by admin on Tue Apr 01 19:50:01 GMT 2025 , Edited by admin on Tue Apr 01 19:50:01 GMT 2025
PRIMARY
NSC
295709
Created by admin on Tue Apr 01 19:50:01 GMT 2025 , Edited by admin on Tue Apr 01 19:50:01 GMT 2025
PRIMARY
FDA UNII
G6GU7GHZ98
Created by admin on Tue Apr 01 19:50:01 GMT 2025 , Edited by admin on Tue Apr 01 19:50:01 GMT 2025
PRIMARY