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

Details

Stereochemistry ACHIRAL
Molecular Formula C10H7N3S
Molecular Weight 201.248
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOTHIAZOLO(5,4-B)QUINOLIN-3(2H)-IMINE

SMILES

N=C1NSC2=NC3=CC=CC=C3C=C12

InChI

InChIKey=JEKVARRIYKFDHJ-UHFFFAOYSA-N
InChI=1S/C10H7N3S/c11-9-7-5-6-3-1-2-4-8(6)12-10(7)14-13-9/h1-5H,(H2,11,13)

HIDE SMILES / InChI

Molecular Formula C10H7N3S
Molecular Weight 201.248
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 19:48:43 GMT 2025
Edited
by admin
on Tue Apr 01 19:48:43 GMT 2025
Record UNII
CL64H5Y9YY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOTHIAZOLO(5,4-B)QUINOLIN-3(2H)-IMINE
Systematic Name English
NSC-329309
Preferred Name English
ISOTHIAZOLO(5,4-B)QUINOLIN-3-AMINE
Systematic Name English
Code System Code Type Description
NSC
329309
Created by admin on Tue Apr 01 19:48:43 GMT 2025 , Edited by admin on Tue Apr 01 19:48:43 GMT 2025
PRIMARY
CAS
69513-37-7
Created by admin on Tue Apr 01 19:48:43 GMT 2025 , Edited by admin on Tue Apr 01 19:48:43 GMT 2025
PRIMARY
EPA CompTox
DTXSID60219752
Created by admin on Tue Apr 01 19:48:43 GMT 2025 , Edited by admin on Tue Apr 01 19:48:43 GMT 2025
PRIMARY
PUBCHEM
332486
Created by admin on Tue Apr 01 19:48:43 GMT 2025 , Edited by admin on Tue Apr 01 19:48:43 GMT 2025
PRIMARY
FDA UNII
CL64H5Y9YY
Created by admin on Tue Apr 01 19:48:43 GMT 2025 , Edited by admin on Tue Apr 01 19:48:43 GMT 2025
PRIMARY