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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 P-CHLOROBENZYLPSEUDOTHIURONIUM CHLORIDE

SMILES

Cl.NC(=N)SCC1=CC=C(Cl)C=C1

InChI

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

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C8H9ClN2S
Molecular Weight 200.688
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Structure-activity relationship of S-benzylisothiourea derivatives to induce spherical cells in Escherichia coli.
2004-11
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 20:32:24 GMT 2025
Edited
by admin
on Mon Mar 31 20:32:24 GMT 2025
Record UNII
UG8Z59JOWY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
P-CHLOROBENZYLPSEUDOTHIURONIUM CHLORIDE
Common Name English
2-(P-CHLOROBENZYL)-2-THIOPSEUDOUREA HYDROCHLORIDE
Preferred Name English
PSEUDOUREA, 2-(P-CHLOROBENZYL)-2-THIO-, MONOHYDROCHLORIDE
Common Name English
CARBAMIMIDOTHIOIC ACID (4-CHLOROPHENYL)METHYL ESTER HYDROCHLORIDE
Systematic Name English
S-(P-CHLOROBENZYL)THIOURONIUM CHLORIDE
Common Name English
CARBAMIMIDOTHIOIC ACID, (4-CHLOROPHENYL)METHYL ESTER, MONOHYDROCHLORIDE
Common Name English
NSC-176723
Code English
P-CHLOROBENZYLPSEUDOTHIURONIUM HYDROCHLORIDE [MI]
Common Name English
Code System Code Type Description
MERCK INDEX
m1067
Created by admin on Mon Mar 31 20:32:24 GMT 2025 , Edited by admin on Mon Mar 31 20:32:24 GMT 2025
PRIMARY Merck Index
EPA CompTox
DTXSID0060270
Created by admin on Mon Mar 31 20:32:24 GMT 2025 , Edited by admin on Mon Mar 31 20:32:24 GMT 2025
PRIMARY
NSC
176723
Created by admin on Mon Mar 31 20:32:24 GMT 2025 , Edited by admin on Mon Mar 31 20:32:24 GMT 2025
PRIMARY
PUBCHEM
68342
Created by admin on Mon Mar 31 20:32:24 GMT 2025 , Edited by admin on Mon Mar 31 20:32:24 GMT 2025
PRIMARY
CAS
544-47-8
Created by admin on Mon Mar 31 20:32:24 GMT 2025 , Edited by admin on Mon Mar 31 20:32:24 GMT 2025
PRIMARY
FDA UNII
UG8Z59JOWY
Created by admin on Mon Mar 31 20:32:24 GMT 2025 , Edited by admin on Mon Mar 31 20:32:24 GMT 2025
PRIMARY
ECHA (EC/EINECS)
208-871-0
Created by admin on Mon Mar 31 20:32:24 GMT 2025 , Edited by admin on Mon Mar 31 20:32:24 GMT 2025
PRIMARY