Basic information
- CAS
23517-81-9- Standard SMILES
CCCCC1SC(=S)N(c2cccc3ccccc23)C1=O- InChIKey
XLVKPLNMULVMOQ-UHFFFAOYSA-N- Molecular formula
- C17H17NOS2
- Average molar mass
- 315.5 g/mol
- Monoisotopic mass
- 315.07515651
Names & identifiers
- Preferred name
- 5-Butyl-3-(naphthalen-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
- IUPAC
- 5-butyl-3-naphthalen-1-yl-2-sulfanylidene-1,3-thiazolidin-4-one
Names & synonyms
23517-81-9DTXSID609462535-BUTYL-3-(NAPHTHALEN-1-YL)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONERefChem:1072758DTXCID4013745435-Butyl-3-(1-naphthyl)rhodanineRhodanine, 5-butyl-3-(1-naphthyl)-
Database identifiers
- CAS
23517-81-9- PubChem CID
- 211705
- DTXSID
DTXSID60946253
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 77.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 412
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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