Basic information
- Standard SMILES
CC(=O)SCCCC(=O)N1CC(=O)C[C@H]1C(=O)O- InChIKey
UIUKETVIGKTXHZ-VIFPVBQESA-N- Molecular formula
- C11H15NO5S
- Average molar mass
- 273.31 g/mol
Names & identifiers
- Preferred name
- 1-[4-(acetylthio)-1-oxobutyl]-4-oxo-L-proline
- IUPAC
- (2S)-1-(4-acetylsulfanylbutanoyl)-4-oxopyrrolidine-2-carboxylic acid
Names & synonyms
SCHEMBL11272121UIUKETVIGKTXHZ-VIFPVBQESA-N1-[4-(acetylthio)-1-oxobutyl]-4-oxo-L-proline
Database identifiers
- PubChem CID
- 54355458
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 117 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 382
Related reactions
4 records
Compound notes
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