2-(4-Oxo-2-thioxo-thiazolidin-3-ylamino)-benzoic acid

HCID 4594337
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(O)c1ccccc1NN1C(=O)CSC1=S
InChIKey
SETOLJUJJVAFHB-UHFFFAOYSA-N
Molecular formula
C10H8N2O3S2
Average molar mass
268.3 g/mol

Names & identifiers

Preferred name
2-(4-Oxo-2-thioxo-thiazolidin-3-ylamino)-benzoic acid
IUPAC
2-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)amino]benzoic acid

Names & synonyms

SCHEMBL3030170SETOLJUJJVAFHB-UHFFFAOYSA-N2-(4-oxo-2-thioxo-thiazolidin-3-ylamino)-benzoic acid

Database identifiers

PubChem CID
4594337

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
127 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
17

Related reactions

11 records
New reaction record

Compound notes

Loading…