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Details

Stereochemistry ACHIRAL
Molecular Formula C8H10N2S.ClH
Molecular Weight 202.704
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of S-BENZYLTHIOUREA HYDROCHLORIDE

SMILES

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

InChI

InChIKey=WJAASTDRAAMYNK-UHFFFAOYSA-N
InChI=1S/C8H10N2S.ClH/c9-8(10)11-6-7-4-2-1-3-5-7;/h1-5H,6H2,(H3,9,10);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 C8H10N2S
Molecular Weight 166.243
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
S-benzylisothiourea derivatives as small-molecule inhibitors of indoleamine-2,3-dioxygenase.
2010-09-01
Phylogenetic analyses and detection of viridans streptococci based on sequences and denaturing gradient gel electrophoresis of the rod shape-determining protein gene.
2009-08-28
In vivo localizations of membrane stress controllers PspA and PspG in Escherichia coli.
2009-08
Anti-infectious effect of S-benzylisothiourea compound A22, which inhibits the actin-like protein, MreB, in Shigella flexneri.
2008-07
The essential peptidoglycan glycosyltransferase MurG forms a complex with proteins involved in lateral envelope growth as well as with proteins involved in cell division in Escherichia coli.
2007-08
Structure-activity relationship study of the bacterial actin-like protein MreB inhibitors: effects of substitution of benzyl group in S-benzylisothiourea.
2007-01
Structure-activity relationship of S-benzylisothiourea derivatives to induce spherical cells in Escherichia coli.
2004-11
Novel S-benzylisothiourea compound that induces spherical cells in Escherichia coli probably by acting on a rod-shape-determining protein(s) other than penicillin-binding protein 2.
2002-12
Substance Class Chemical
Created
by admin
on Mon Mar 31 21:17:27 GMT 2025
Edited
by admin
on Mon Mar 31 21:17:27 GMT 2025
Record UNII
QJ9N8049ND
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-179799
Preferred Name English
S-BENZYLTHIOUREA HYDROCHLORIDE
MI  
Systematic Name English
S-BENZYLTHIURONIUM CHLORIDE
Common Name English
S-BENZYLISOTHIOURONIUM CHLORIDE
Common Name English
S-BENZYLISOTHIURONIUM CHLORIDE
Common Name English
BENZYLISOTHIOURONIUM CHLORIDE
Common Name English
S-BENZYLTHIOPSEUDOUREA HYDROCHLORIDE
Common Name English
2-BENZYL-2-THIOPSEUDOUREA HYDROCHLORIDE
Common Name English
CARBAMIMIDOTHIOIC ACID, PHENYLMETHYL ESTER, MONOHYDROCHLORIDE
Common Name English
S-BENZYLISOTHIOUREA HYDROCHLORIDE
Systematic Name English
BENZYLISOTHIURONIUM CHLORIDE
Common Name English
PSEUDOUREA, 2-BENZYL-2-THIO-, MONOHYDROCHLORIDE
Common Name English
S-BENZYLTHIOUREA HYDROCHLORIDE [MI]
Common Name English
S-BENZYLTHIOURONIUM CHLORIDE
Systematic Name English
PSEUDOUREA, 2-BENZYL-2-THIO-, HYDROCHLORIDE
Common Name English
BENZYLISOTHIOUREA HYDROCHLORIDE
Systematic Name English
CARBAMIMIDOTHIOIC ACID, PHENYLMETHYL ESTER, HYDROCHLORIDE (1:1)
Common Name English
S-BENZYLTHIOFORMAMIDINE HYDROCHLORIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
10852
Created by admin on Mon Mar 31 21:17:27 GMT 2025 , Edited by admin on Mon Mar 31 21:17:27 GMT 2025
PRIMARY
EPA CompTox
DTXSID0060222
Created by admin on Mon Mar 31 21:17:27 GMT 2025 , Edited by admin on Mon Mar 31 21:17:27 GMT 2025
PRIMARY
MERCK INDEX
m2418
Created by admin on Mon Mar 31 21:17:27 GMT 2025 , Edited by admin on Mon Mar 31 21:17:27 GMT 2025
PRIMARY Merck Index
ECHA (EC/EINECS)
208-688-6
Created by admin on Mon Mar 31 21:17:27 GMT 2025 , Edited by admin on Mon Mar 31 21:17:27 GMT 2025
PRIMARY
FDA UNII
QJ9N8049ND
Created by admin on Mon Mar 31 21:17:27 GMT 2025 , Edited by admin on Mon Mar 31 21:17:27 GMT 2025
PRIMARY
NSC
179799
Created by admin on Mon Mar 31 21:17:27 GMT 2025 , Edited by admin on Mon Mar 31 21:17:27 GMT 2025
PRIMARY
CAS
538-28-3
Created by admin on Mon Mar 31 21:17:27 GMT 2025 , Edited by admin on Mon Mar 31 21:17:27 GMT 2025
PRIMARY