Basic information
- CAS
13553-69-0- Standard SMILES
CCS(CC)=NS(=O)(=O)c1ccc(C)cc1- InChIKey
NRZNFLKTBNIHFE-UHFFFAOYSA-N- Molecular formula
- C11H17NO2S2
- Average molar mass
- 259.4 g/mol
- Monoisotopic mass
- 259.07007113
Names & identifiers
- Preferred name
- N-(diethyl-lambda4-sulfanylidene)-4-methylbenzenesulfonamide
- IUPAC
- N-(diethyl-λ4-sulfanylidene)-4-methylbenzenesulfonamide
Names & synonyms
13553-69-0NSC85734SCHEMBL2282918DTXSID80929043NSC-85734N-(Diethyl-lambda~4~-sulfanylidene)-4-methylbenzene-1-sulfonamide
Database identifiers
- CAS
13553-69-0- PubChem CID
- 257583
- DTXSID
DTXSID80929043- Nikkaji
- J1.264.400K
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 74.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 329
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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