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Details

Stereochemistry ACHIRAL
Molecular Formula C8H9ClN2S.ClH
Molecular Weight 237.149
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride

SMILES

Cl.NC(=N)SCC1=CC=CC=C1Cl

InChI

InChIKey=CEICVYXCGHTEIT-UHFFFAOYSA-N
InChI=1S/C8H9ClN2S.ClH/c9-7-4-2-1-3-6(7)5-12-8(10)11;/h1-4H,5H2,(H3,10,11);1H

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
NSC-60041
Preferred Name English
Pseudourea, 2-(2-chlorobenzyl)-2-thio-, hydrochloride
Common Name English
2-Chlorophenylmethyl carbamimidothioate hydrochloride
Systematic Name English
Pseudourea, 2-(o-chlorobenzyl)-2-thio-, hydrochloride
Systematic Name English
Carbamimidothioic acid, (2-chlorophenyl)methyl ester, hydrochloride (1:1)
Systematic Name English
Carbamimidothioic acid, (2-chlorophenyl)methyl ester, hydrochloride
Common Name English
Code System Code Type Description
PUBCHEM
199161
Created by admin on Wed Apr 02 17:52:24 GMT 2025 , Edited by admin on Wed Apr 02 17:52:24 GMT 2025
PRIMARY
CAS
3778-85-6
Created by admin on Wed Apr 02 17:52:24 GMT 2025 , Edited by admin on Wed Apr 02 17:52:24 GMT 2025
PRIMARY
EPA CompTox
DTXSID00191225
Created by admin on Wed Apr 02 17:52:24 GMT 2025 , Edited by admin on Wed Apr 02 17:52:24 GMT 2025
PRIMARY
FDA UNII
9X9QY6D7C5
Created by admin on Wed Apr 02 17:52:24 GMT 2025 , Edited by admin on Wed Apr 02 17:52:24 GMT 2025
PRIMARY
NSC
60041
Created by admin on Wed Apr 02 17:52:24 GMT 2025 , Edited by admin on Wed Apr 02 17:52:24 GMT 2025
PRIMARY
NIH
NCATS
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