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

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 C8H10N2S
Molecular Weight 166.243
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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

Approval Year

PubMed

PubMed

TitleDatePubMed
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 Dec
Structure-activity relationship of S-benzylisothiourea derivatives to induce spherical cells in Escherichia coli.
2004 Nov
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 Aug
Structure-activity relationship study of the bacterial actin-like protein MreB inhibitors: effects of substitution of benzyl group in S-benzylisothiourea.
2007 Jan
Anti-infectious effect of S-benzylisothiourea compound A22, which inhibits the actin-like protein, MreB, in Shigella flexneri.
2008 Jul
In vivo localizations of membrane stress controllers PspA and PspG in Escherichia coli.
2009 Aug
Phylogenetic analyses and detection of viridans streptococci based on sequences and denaturing gradient gel electrophoresis of the rod shape-determining protein gene.
2009 Aug 28
S-benzylisothiourea derivatives as small-molecule inhibitors of indoleamine-2,3-dioxygenase.
2010 Sep 1
Substance Class Chemical
Created
by admin
on Sat Dec 16 03:12:24 GMT 2023
Edited
by admin
on Sat Dec 16 03:12:24 GMT 2023
Record UNII
QJ9N8049ND
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
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
NSC-179799
Code 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 Sat Dec 16 03:12:24 GMT 2023 , Edited by admin on Sat Dec 16 03:12:24 GMT 2023
PRIMARY
EPA CompTox
DTXSID0060222
Created by admin on Sat Dec 16 03:12:24 GMT 2023 , Edited by admin on Sat Dec 16 03:12:24 GMT 2023
PRIMARY
MERCK INDEX
m2418
Created by admin on Sat Dec 16 03:12:24 GMT 2023 , Edited by admin on Sat Dec 16 03:12:24 GMT 2023
PRIMARY Merck Index
ECHA (EC/EINECS)
208-688-6
Created by admin on Sat Dec 16 03:12:24 GMT 2023 , Edited by admin on Sat Dec 16 03:12:24 GMT 2023
PRIMARY
FDA UNII
QJ9N8049ND
Created by admin on Sat Dec 16 03:12:24 GMT 2023 , Edited by admin on Sat Dec 16 03:12:24 GMT 2023
PRIMARY
NSC
179799
Created by admin on Sat Dec 16 03:12:24 GMT 2023 , Edited by admin on Sat Dec 16 03:12:24 GMT 2023
PRIMARY
CAS
538-28-3
Created by admin on Sat Dec 16 03:12:24 GMT 2023 , Edited by admin on Sat Dec 16 03:12:24 GMT 2023
PRIMARY