Basic information
- Standard SMILES
Cl.Clc1ccc(CSc2ccc(Cl)cc2C2=NCCN2)cc1- InChIKey
LAFCBQBDWJXCIS-UHFFFAOYSA-N- Molecular formula
- C16H15Cl3N2S
- Average molar mass
- 373.7 g/mol
- Monoisotopic mass
- 372.002153
Names & identifiers
- Preferred name
- 2-[2'-(4"-Chlorobenzylthio)-5'-chlorophenyl]-imidazoline hydrochloride
- IUPAC
- 2-[5-chloro-2-[(4-chlorophenyl)methylsulfanyl]phenyl]-4,5-dihydro-1H-imidazole;hydrochloride
Names & synonyms
SCHEMBL10907884LAFCBQBDWJXCIS-UHFFFAOYSA-N2-[2'-(4"-chlorobenzylthio)-5'-chlorophenyl]-imidazoline hydrochloride
Database identifiers
- PubChem CID
- 70469823
Properties
Computed structural properties
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 369
Related reactions
2 records
Compound notes
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