Basic information
- Standard SMILES
CSc1cccc(SC)c1S(=O)(=O)NC(C)(C)C- InChIKey
SXQHLUZVBVEABP-UHFFFAOYSA-N- Molecular formula
- C12H19NO2S3
- Average molar mass
- 305.5 g/mol
Names & identifiers
- Preferred name
- 2,6-bis(methylthio)-N-(1,1-dimethylethyl)benzenesulfonamide
- IUPAC
- N-tert-butyl-2,6-bis(methylsulfanyl)benzenesulfonamide
Names & synonyms
SCHEMBL10572395SXQHLUZVBVEABP-UHFFFAOYSA-N2,6-bis(methylthio)-N-(1,1-dimethylethyl)benzenesulfonamide
Database identifiers
- PubChem CID
- 13670366
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 344
Related reactions
5 records
Compound notes
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