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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H8O2S
Molecular Weight 168.213
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of S-(HYDROXYMETHYL) BENZENECARBOTHIOATE

SMILES

OCSC(=O)C1=CC=CC=C1

InChI

InChIKey=MNTZJQAAOYSCMM-UHFFFAOYSA-N
InChI=1S/C8H8O2S/c9-6-11-8(10)7-4-2-1-3-5-7/h1-5,9H,6H2

HIDE SMILES / InChI

Approval Year

Name Type Language
S-(HYDROXYMETHYL) BENZENECARBOTHIOATE
Common Name English
NSC-146570
Code English
BENZENECARBOTHIOIC ACID, S-(HYDROXYMETHYL) ESTER
Systematic Name English
BENZOIC ACID, THIO-, S-(HYDROXYMETHYL) ESTER
Common Name English
METHANOL, MERCAPTO-, S-BENZOATE
Common Name English
((HYDROXYMETHYL)SULFANYL)(PHENYL)METHANONE
Systematic Name English
BENZOYL OXYMETHYL THIAMINE
Common Name English
Code System Code Type Description
NSC
146570
Created by admin on Sat Dec 16 19:10:53 GMT 2023 , Edited by admin on Sat Dec 16 19:10:53 GMT 2023
PRIMARY
PUBCHEM
287157
Created by admin on Sat Dec 16 19:10:53 GMT 2023 , Edited by admin on Sat Dec 16 19:10:53 GMT 2023
PRIMARY
SMS_ID
100000135508
Created by admin on Sat Dec 16 19:10:53 GMT 2023 , Edited by admin on Sat Dec 16 19:10:53 GMT 2023
PRIMARY
EPA CompTox
DTXSID60946657
Created by admin on Sat Dec 16 19:10:53 GMT 2023 , Edited by admin on Sat Dec 16 19:10:53 GMT 2023
PRIMARY
FDA UNII
UJR6N69WMU
Created by admin on Sat Dec 16 19:10:53 GMT 2023 , Edited by admin on Sat Dec 16 19:10:53 GMT 2023
PRIMARY
CAS
23853-33-0
Created by admin on Sat Dec 16 19:10:53 GMT 2023 , Edited by admin on Sat Dec 16 19:10:53 GMT 2023
PRIMARY