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Details

Stereochemistry ACHIRAL
Molecular Formula C9H12N2OS
Molecular Weight 196.269
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of S-(2-AMINOETHYL)BENZOTHIOHYDROXIMIC ACID

SMILES

NCCS\C(=N/O)C1=CC=CC=C1

InChI

InChIKey=IEPUWBFKPOEUBD-LUAWRHEFSA-N
InChI=1S/C9H12N2OS/c10-6-7-13-9(11-12)8-4-2-1-3-5-8/h1-5,12H,6-7,10H2/b11-9-

HIDE SMILES / InChI

Molecular Formula C9H12N2OS
Molecular Weight 196.269
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:25:41 GMT 2023
Edited
by admin
on Sat Dec 16 11:25:41 GMT 2023
Record UNII
796A65379Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
S-(2-AMINOETHYL)BENZOTHIOHYDROXIMIC ACID
Systematic Name English
S-(2-AMINOETHYL)-BENZOTHIOHYDROXIMATE
Systematic Name English
BENZENECARBOXIMIDOTHIOIC ACID, N-HYDROXY-, 2-AMINOETHYL ESTER
Systematic Name English
Code System Code Type Description
FDA UNII
796A65379Q
Created by admin on Sat Dec 16 11:25:41 GMT 2023 , Edited by admin on Sat Dec 16 11:25:41 GMT 2023
PRIMARY
CAS
59470-56-3
Created by admin on Sat Dec 16 11:25:41 GMT 2023 , Edited by admin on Sat Dec 16 11:25:41 GMT 2023
PRIMARY
PUBCHEM
21544447
Created by admin on Sat Dec 16 11:25:41 GMT 2023 , Edited by admin on Sat Dec 16 11:25:41 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT