Basic information
- CAS
218286-92-1- Standard SMILES
O=C(CSc1ccccc1)NCc1cccs1- InChIKey
IFTNUYLQVKRRNN-UHFFFAOYSA-N- Molecular formula
- C13H13NOS2
- Average molar mass
- 263.4 g/mol
- Monoisotopic mass
- 263.04385639
Names & identifiers
- Preferred name
- 2-(Phenylthio)-N-(2-thienylmethyl)acetamide
- IUPAC
- 2-phenylsulfanyl-N-(thiophen-2-ylmethyl)acetamide
Names & synonyms
2-(Phenylthio)-N-(2-thienylmethyl)acetamide218286-92-1RefChem:254602Maybridge3_000169Oprea1_815719DTXSID601261388HMS1431H15AKOS008350809IDI1_0115562-(Phenylsulfanyl)-N-[(thiophen-2-yl)methyl]acetamide
Database identifiers
- CAS
218286-92-1- PubChem CID
- 737239
- DTXSID
DTXSID601261388
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 82.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 242
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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