Basic information
- Standard SMILES
CN(C)c1cccc(CSC2=NC(C)(C)C(SCc3cccc(N(C)C)c3)=N2)c1- InChIKey
OOZLHAOGZJWXCU-UHFFFAOYSA-N- Molecular formula
- C23H30N4S2
- Average molar mass
- 426.6 g/mol
Names & identifiers
- Preferred name
- 2,4-bis(3-dimethylaminobenzylthio)-5,5-dimethyl-5H-imidazole
- IUPAC
- 3-[[2-[[3-(dimethylamino)phenyl]methylsulfanyl]-5,5-dimethylimidazol-4-yl]sulfanylmethyl]-N,N-dimethylaniline
Names & synonyms
SCHEMBL8655354OOZLHAOGZJWXCU-UHFFFAOYSA-N2,4-bis(3-dimethylaminobenzylthio)-5,5-dimethyl-5H-imidazole2,4-bis-(3-dimethylaminobenzylthio)-5,5-dimethyl-5H-imidazole
Database identifiers
- PubChem CID
- 18934902
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 81.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 600
Related reactions
2 records
Compound notes
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