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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H9N3O3S2
Molecular Weight 247.295
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of P-[2-(aminothioxomethyl)hydrazino]benzenesulfonate

SMILES

NC(=S)NNC1=CC=C(C=C1)S(O)(=O)=O

InChI

InChIKey=QAZGMZLTVBQCOO-UHFFFAOYSA-N
InChI=1S/C7H9N3O3S2/c8-7(14)10-9-5-1-3-6(4-2-5)15(11,12)13/h1-4,9H,(H3,8,10,14)(H,11,12,13)

HIDE SMILES / InChI

Molecular Formula C7H9N3O3S2
Molecular Weight 247.295
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 Wed Apr 02 18:03:43 GMT 2025
Edited
by admin
on Wed Apr 02 18:03:43 GMT 2025
Record UNII
DQE74TV9AZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-[2-(Aminothioxomethyl)hydrazinyl]benzenesulfonic acid
Preferred Name English
P-[2-(aminothioxomethyl)hydrazino]benzenesulfonate
Systematic Name English
Benzenesulfonic acid, 4-[2-(aminothioxomethyl)hydrazinyl]-
Systematic Name English
Benzenesulfonic acid, 4-[2-(aminothioxomethyl)hydrazino]-
Systematic Name English
Code System Code Type Description
CAS
790155-78-1
Created by admin on Wed Apr 02 18:03:43 GMT 2025 , Edited by admin on Wed Apr 02 18:03:43 GMT 2025
PRIMARY
PUBCHEM
3034778
Created by admin on Wed Apr 02 18:03:43 GMT 2025 , Edited by admin on Wed Apr 02 18:03:43 GMT 2025
PRIMARY
FDA UNII
DQE74TV9AZ
Created by admin on Wed Apr 02 18:03:43 GMT 2025 , Edited by admin on Wed Apr 02 18:03:43 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT