5-[(4-Oxochromen-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Basic information
- CAS
62484-70-2- Standard SMILES
O=C1NC(=S)SC1=Cc1coc2ccccc2c1=O- InChIKey
VOQKYYMMDXMDIG-UHFFFAOYSA-N- Molecular formula
- C13H7NO3S2
- Average molar mass
- 289.3 g/mol
- Monoisotopic mass
- 288.98673543
Names & identifiers
- Preferred name
- 5-[(4-Oxochromen-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
- IUPAC
- 5-[(4-oxochromen-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Names & synonyms
62484-70-25-[(4-oxochromen-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-oneAC1MWQA5C13H7NO3S2DTXSID803959465-[(4-oxochromen-3-yl)methylene]-2-thioxo-thiazolidin-4-one5-[(4-Oxo-4H-1-benzopyran-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Database identifiers
- CAS
62484-70-2- PubChem CID
- 3753348
- DTXSID
DTXSID80395946
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 524
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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