Basic information
- Standard SMILES
C[C@@H](C(=O)N1CCCCC1)N1CC[C@H](NS(=O)(=O)/C=C/c2ccc(Cl)cc2)C1=O- InChIKey
JIYABKKVEOGWGN-WLIXIEMPSA-N- Molecular formula
- C20H26ClN3O4S
- Average molar mass
- 440 g/mol
Names & identifiers
- Preferred name
- (E)-2-(4-Chlorophenyl)-N-{(3S)-1-[(1S)-1-methyl-2-oxo-2-piperidin-1-ylethyl]-2-oxopyrrolidin-3-yl}ethenesulfonamide
- IUPAC
- (E)-2-(4-chlorophenyl)-N-[(3S)-2-oxo-1-[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]pyrrolidin-3-yl]ethenesulfonamide
Names & synonyms
SCHEMBL5143286JIYABKKVEOGWGN-WLIXIEMPSA-N(E)-2-(4-Chlorophenyl)-N-{(3S)-1-[(1S)-1-methyl-2-oxo-2-piperidin-1 -ylethyl]-2-oxopyrrolidin-3-yl}ethenesulfonamide(E)-2-(4-Chlorophenyl)-N-{(3S)-1-[(1S)-1-methyl-2-oxo-2-piperidin-1-ylethyl]-2-oxopyrrolidin-3-yl}ethenesulfonamide
Database identifiers
- PubChem CID
- 10138121
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 95.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 722
Related reactions
3 records
Compound notes
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