Basic information
- Standard SMILES
Cc1ccc(N2CCSC(C(O)C(=O)Nc3ccc(-c4noc(=O)[nH]4)cc3)C2=O)cc1- InChIKey
MCTZRTXZQCHRFL-UHFFFAOYSA-N- Molecular formula
- C21H20N4O5S
- Average molar mass
- 440.5 g/mol
- Monoisotopic mass
- 440.11544092
Names & identifiers
- Preferred name
- 2-hydroxy-N-[4-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]-2-[3-oxo-4-(p-tolyl)thiomorpholin-2-yl]acetamide
- IUPAC
- 2-hydroxy-2-[4-(4-methylphenyl)-3-oxothiomorpholin-2-yl]-N-[4-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]acetamide
Names & synonyms
SCHEMBL1948986MCTZRTXZQCHRFL-UHFFFAOYSA-N2-hydroxy-N-[4-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]-2-[3-oxo-4-(p-tolyl)thiomorpholin-2-yl]acetamide
Database identifiers
- PubChem CID
- 136337791
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 146 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 731
Related reactions
1 records
Compound notes
Loading…