Acetanilide, 2-(diethylamino)-2',6'-dimethylthio-, monohydrochloride
Basic information
- CAS
13327-13-4- Standard SMILES
CC[NH+](CC)CC(=O)Nc1c(SC)cccc1SC.[Cl-]- InChIKey
UKMBFXPUICHHNR-UHFFFAOYSA-N- Molecular formula
- C14H23ClN2OS2
- Average molar mass
- 334.9 g/mol
- Monoisotopic mass
- 334.0940334
Names & identifiers
- Preferred name
- Acetanilide, 2-(diethylamino)-2',6'-dimethylthio-, monohydrochloride
- IUPAC
- [2-[2,6-bis(methylsulfanyl)anilino]-2-oxoethyl]-diethylazanium chloride
Names & synonyms
Diaethylaminothioacetyl-2,6-xylidin hydrochlorid [German]2-(Diethylamino)-2',6'-dimethylthioacetanilide hydrochloride2',6'-Acetoxylidide, 2-(diethylamino)thio-, monohydrochlorideDiaethylaminothioacetyl-2,6-xylidin hydrochloridACETANILIDE, 2-(DIETHYLAMINO)-2',6'-DIMETHYLTHIO-, MONOHYDROCHLORIDE13327-13-4RefChem:315712
Database identifiers
- CAS
13327-13-4- PubChem CID
- 25877
Properties
Computed structural properties
- Topological polar surface area
- 84.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 260
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Compound notes
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