Basic information
- CAS
101651-69-8- Standard SMILES
CC[NH+](CC)CCSCC(=O)Nc1c(Cl)cccc1Cl.[Cl-]- InChIKey
BIEJESCEKNFHHW-UHFFFAOYSA-N- Molecular formula
- C14H21Cl3N2OS
- Average molar mass
- 371.8 g/mol
- Monoisotopic mass
- 370.044018
Names & identifiers
- Preferred name
- Acetanilide, 2',6'-dichloro-2-(2-(diethylamino)ethyl)thio-, hydrochloride
- IUPAC
- 2-[2-(2,6-dichloroanilino)-2-oxoethyl]sulfanylethyl-diethylazanium chloride
Names & synonyms
101651-69-8C 49102',6'-Dichloro-2-(2-(diethylamino)ethyl)thioacetanilide hydrochlorideACETANILIDE, 2',6'-DICHLORO-2-(2-(DIETHYLAMINO)ETHYL)THIO-, HYDROCHLORIDERefChem:3156692-[2-(2,6-dichloroanilino)-2-oxoethyl]sulfanylethyl-diethylazanium;chloride2-[(2,6-DICHLOROPHENYL)CARBAMOYLMETHYLSULFANYL]ETHYL-DIETHYL-AZANIUM C HLORIDE
Database identifiers
- CAS
101651-69-8- PubChem CID
- 58630
Properties
Computed structural properties
- Topological polar surface area
- 58.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 280
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…