rac-(4S*,5R*)-2-(4-tert-butyl-5-dimethylsulfamoyl-2-ethoxy-phenyl)-4,5-bis-(4-chloro-phenyl)-4,5-dimethyl-4,5-dihydro-imidazole-1-carbonyl chloride

HCID 86612876

Basic information

Standard SMILES
CCOc1cc(C(C)(C)C)c(S(=O)(=O)N(C)C)cc1C1=NC(C)(c2ccc(Cl)cc2)C(C)(c2ccc(Cl)cc2)N1C(=O)Cl
InChIKey
NSUAPQOIKZATBG-UHFFFAOYSA-N
Molecular formula
C32H36Cl3N3O4S
Average molar mass
665.1 g/mol

Names & identifiers

Preferred name
rac-(4S*,5R*)-2-(4-tert-butyl-5-dimethylsulfamoyl-2-ethoxy-phenyl)-4,5-bis-(4-chloro-phenyl)-4,5-dimethyl-4,5-dihydro-imidazole-1-carbonyl chloride
IUPAC
2-[4-tert-butyl-5-(dimethylsulfamoyl)-2-ethoxyphenyl]-4,5-bis(4-chlorophenyl)-4,5-dimethylimidazole-1-carbonyl chloride

Names & synonyms

SCHEMBL3546689NSUAPQOIKZATBG-UHFFFAOYSA-Nrac-(4S*,5R*)-2-(4-tert-butyl-5-dimethylsulfamoyl-2-ethoxy-phenyl)-4,5-bis-(4-chloro-phenyl)-4,5-dimethyl-4,5-dihydro-imidazole-1-carbonyl chloride

Database identifiers

PubChem CID
86612876

Properties

Computed structural properties

XLogP
7.9
Topological polar surface area
87.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
43

Related reactions

3 records

Compound notes

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