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

Details

Stereochemistry ACHIRAL
Molecular Formula C14H12N2O3S2
Molecular Weight 320.387
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)-

SMILES

CC1=CC=C2N=C(SC2=C1)C3=CC=C(N)C(=C3)S(O)(=O)=O

InChI

InChIKey=SGFXNJIQRFEOIA-UHFFFAOYSA-N
InChI=1S/C14H12N2O3S2/c1-8-2-5-11-12(6-8)20-14(16-11)9-3-4-10(15)13(7-9)21(17,18)19/h2-7H,15H2,1H3,(H,17,18,19)

HIDE SMILES / InChI

Molecular Formula C14H12N2O3S2
Molecular Weight 320.387
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 Sat Dec 16 12:25:31 GMT 2023
Edited
by admin
on Sat Dec 16 12:25:31 GMT 2023
Record UNII
8MMJ3X6Y7A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)-
Systematic Name English
2-Amino-5-(6-methyl-2-benzothiazolyl)benzenesulfonic acid
Systematic Name English
NSC-26700
Code English
Code System Code Type Description
PUBCHEM
66689
Created by admin on Sat Dec 16 12:25:31 GMT 2023 , Edited by admin on Sat Dec 16 12:25:31 GMT 2023
PRIMARY
FDA UNII
8MMJ3X6Y7A
Created by admin on Sat Dec 16 12:25:31 GMT 2023 , Edited by admin on Sat Dec 16 12:25:31 GMT 2023
PRIMARY
EPA CompTox
DTXSID0059037
Created by admin on Sat Dec 16 12:25:31 GMT 2023 , Edited by admin on Sat Dec 16 12:25:31 GMT 2023
PRIMARY
ECHA (EC/EINECS)
202-116-9
Created by admin on Sat Dec 16 12:25:31 GMT 2023 , Edited by admin on Sat Dec 16 12:25:31 GMT 2023
PRIMARY
CAS
92-01-3
Created by admin on Sat Dec 16 12:25:31 GMT 2023 , Edited by admin on Sat Dec 16 12:25:31 GMT 2023
PRIMARY