Basic information
- Standard SMILES
C[C@@H](C(=O)N1CCCCC1)N1CC[C@H](N(CC#N)S(=O)(=O)c2ccc3cc(Cl)ccc3c2)C1=O- InChIKey
PZEJKTBNNFEUCR-JTSKRJEESA-N- Molecular formula
- C24H27ClN4O4S
- Average molar mass
- 503 g/mol
Names & identifiers
- Preferred name
- 6-Chloro-N-(cyanomethyl)-N-{(3S)-1-[(1S)-1-methyl-2-oxo-2-piperidin-1-ylethyl]-2-oxopyrrolidin-3-yl}naphthalene-2-sulfonamide
- IUPAC
- 6-chloro-N-(cyanomethyl)-N-[(3S)-2-oxo-1-[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]pyrrolidin-3-yl]naphthalene-2-sulfonamide
Names & synonyms
SCHEMBL5143442PZEJKTBNNFEUCR-JTSKRJEESA-N6-Chloro-N-(cyanomethyl)-N-{(3S)-1-[(1S)-1-methyl-2-oxo-2-piperidin-1-ylethyl]-2-oxopyrrolidin-3-yl}naphthalene-2-sulfonamide
Database identifiers
- PubChem CID
- 86593863
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 923
Related reactions
3 records
Linked notes
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