1-(3-Fluoro-4-methoxyphenyl)-2-[4-(methylthio)phenyl]-ethan-1-one oxime
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Basic information
- Standard SMILES
COc1ccc(C(Cc2ccc(SC)cc2)=NO)cc1F- InChIKey
GTLLWNFTIBVLLR-UHFFFAOYSA-N- Molecular formula
- C16H16FNO2S
- Average molar mass
- 305.4 g/mol
- Monoisotopic mass
- 305.08857809
Names & identifiers
- Preferred name
- 1-(3-Fluoro-4-methoxyphenyl)-2-[4-(methylthio)phenyl]-ethan-1-one oxime
- IUPAC
- N-[1-(3-fluoro-4-methoxyphenyl)-2-(4-methylsulfanylphenyl)ethylidene]hydroxylamine
Names & synonyms
SCHEMBL6168240GTLLWNFTIBVLLR-UHFFFAOYSA-N1-(3-fluoro-4-methoxyphenyl)-2-[4-(methylthio)phenyl]-ethan-1-one oxime
Database identifiers
- PubChem CID
- 73630008
Properties
Computed structural propertiesFilling in
- XLogP
- 4
- Topological polar surface area
- 67.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 345
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Related reactions
6 records
Compound notes
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