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Benzeneacetamide, 2-((4-chlorophenyl)thio)-alpha-(2-(dimethylamino)ethyl)-, monohydrochloride

HCID 44118
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Basic information

CAS
62674-77-5
Standard SMILES
C[NH+](C)CCC(C(N)=O)c1ccccc1Sc1ccc(Cl)cc1.[Cl-]
InChIKey
LMJHYIILVGMBAN-UHFFFAOYSA-N
Molecular formula
C18H22Cl2N2OS
Average molar mass
385.3 g/mol
Monoisotopic mass
384.0829899

Names & identifiers

Preferred name
Benzeneacetamide, 2-((4-chlorophenyl)thio)-alpha-(2-(dimethylamino)ethyl)-, monohydrochloride
IUPAC
[4-amino-3-[2-(4-chlorophenyl)sulfanylphenyl]-4-oxobutyl]-dimethylazanium chloride

Names & synonyms

62674-77-52-((4-Chlorophenyl)thio)-alpha-(2-(dimethylamino)ethyl)benzeneacetamide hydrochlorideBenzeneacetamide, 2-((4-chlorophenyl)thio)-alpha-(2-(dimethylamino)ethyl)-, monohydrochlorideRefChem:324014

Database identifiers

CAS
62674-77-5
PubChem CID
44118

Properties

Computed structural properties

Topological polar surface area
72.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
24
Formal charge
0
Complexity
372

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