3-(3-Chlorophenyl)-5-[[4-(4-methylphenyl)sulfanyl-3-nitrophenyl]methylidene]-1,3-thiazolidine-2,4-dione
Basic information
- CAS
6618-18-4- Standard SMILES
Cc1ccc(Sc2ccc(C=C3SC(=O)N(c4cccc(Cl)c4)C3=O)cc2[N+](=O)[O-])cc1- InChIKey
SEKVAKKOOYORII-UHFFFAOYSA-N- Molecular formula
- C23H15ClN2O4S2
- Average molar mass
- 483 g/mol
- Monoisotopic mass
- 482.016177
Names & identifiers
- Preferred name
- 3-(3-Chlorophenyl)-5-[[4-(4-methylphenyl)sulfanyl-3-nitrophenyl]methylidene]-1,3-thiazolidine-2,4-dione
- IUPAC
- 3-(3-chlorophenyl)-5-[[4-(4-methylphenyl)sulfanyl-3-nitrophenyl]methylidene]-1,3-thiazolidine-2,4-dione
Names & synonyms
6618-18-43-(3-chlorophenyl)-5-[[4-(4-methylphenyl)sulfanyl-3-nitrophenyl]methylidene]-1,3-thiazolidine-2,4-dioneDTXSID804111903-(3-Chlorophenyl)-5-({4-[(4-methylphenyl)sulfanyl]-3-nitrophenyl}methylidene)-1,3-thiazolidine-2,4-dione
Database identifiers
- CAS
6618-18-4- PubChem CID
- 5223063
- DTXSID
DTXSID80411190
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 766
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Compound notes
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