Benzamide, N-[4-[3-[4-(methylthio)phenyl]-1-oxo-2-propenyl]phenyl]-
Basic information
- CAS
255835-29-1- Standard SMILES
CSc1ccc(C=CC(=O)c2ccc(NC(=O)c3ccccc3)cc2)cc1- InChIKey
SWFDZKFFEJMROY-UHFFFAOYSA-N- Molecular formula
- C23H19NO2S
- Average molar mass
- 373.5 g/mol
- Monoisotopic mass
- 373.11365002
Names & identifiers
- Preferred name
- Benzamide, N-[4-[3-[4-(methylthio)phenyl]-1-oxo-2-propenyl]phenyl]-
- IUPAC
- N-[4-[3-(4-methylsulfanylphenyl)prop-2-enoyl]phenyl]benzamide
Names & synonyms
255835-29-1Benzamide, N-[4-[3-[4-(methylthio)phenyl]-1-oxo-2-propenyl]phenyl]-DTXSID70398289N-(4-{3-[4-(Methylsulfanyl)phenyl]prop-2-enoyl}phenyl)benzamide
Database identifiers
- CAS
255835-29-1- PubChem CID
- 3967609
- DTXSID
DTXSID70398289
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 71.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 510
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Compound notes
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