Basic information
- Standard SMILES
CNC(=O)C(Cc1ccc2ccccc2c1)N1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])C(CCO[Si](C)(C)C(C)(C)C)C1=O- InChIKey
KYIBNZMNTTVWRS-UHFFFAOYSA-N- Molecular formula
- C32H42N4O7SSi
- Average molar mass
- 654.8 g/mol
Names & identifiers
- Preferred name
- 2-[3-[2-(Tert-butyldimethylsilanyloxy)ethyl]-4-(2-nitrobenzene-sulfonyl)-2-oxo-piperazin-1-yl]-n-methyl-3-naphthalen-2-yl propionamide
- IUPAC
- 2-[3-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-4-(2-nitrophenyl)sulfonyl-2-oxopiperazin-1-yl]-N-methyl-3-naphthalen-2-ylpropanamide
Names & synonyms
SCHEMBL5995782KYIBNZMNTTVWRS-UHFFFAOYSA-N2-[3-[2-(tert-butyldimethylsilanyloxy)ethyl]-4-(2-nitrobenzene-sulfonyl)-2-oxo-piperazin-1-yl]-n-methyl-3-naphthalen-2-yl propionamide
Database identifiers
- PubChem CID
- 22015697
Properties
Computed structural properties
- Topological polar surface area
- 150 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 11
- Heavy atoms
- 45
- Formal charge
- 0
- Complexity
- 1,170
Related reactions
2 records
Compound notes
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