Ethyl 2-benzoyl-3-[5-[(3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]prop-2-enoate
Basic information
- Standard SMILES
CCOC(=O)C(=CN1C(=O)C(=Cc2cccc([N+](=O)[O-])c2)SC1=S)C(=O)c1ccccc1- InChIKey
WHMIEAOJINUPOU-UHFFFAOYSA-N- Molecular formula
- C22H16N2O6S2
- Average molar mass
- 468.5 g/mol
- Monoisotopic mass
- 468.04497858
Names & identifiers
- Preferred name
- Ethyl 2-benzoyl-3-[5-[(3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]prop-2-enoate
- IUPAC
- ethyl 2-benzoyl-3-[5-[(3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]prop-2-enoate
Database identifiers
- PubChem CID
- 377889
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 167 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 857
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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