Basic information
- Standard SMILES
CN(C)S(=O)(=O)c1c(Cl)ccc(NC(=S)Nc2ccccc2Br)c1O[Si](C)(C)C(C)(C)C- InChIKey
QDOMSFGWZLRVKR-UHFFFAOYSA-N- Molecular formula
- C21H29BrClN3O3S2Si
- Average molar mass
- 579 g/mol
Names & identifiers
- Preferred name
- N-[4-Chloro-2-tert-butyldimethylsilyloxy-3-(N'',N''-dimethylaminosulfonyl)phenyl]-N'-(2-bromophenyl)thiourea
- IUPAC
- 1-(2-bromophenyl)-3-[2-[tert-butyl(dimethyl)silyl]oxy-4-chloro-3-(dimethylsulfamoyl)phenyl]thiourea
Names & synonyms
SCHEMBL2771235QDOMSFGWZLRVKR-UHFFFAOYSA-NN-[4-chloro-2-tert-butyldimethylsilyloxy-3-(N'',N''-dimethylaminosulfonyl)phenyl]-N'-(2-bromophenyl) thioureaN-[4-Chloro-2-tert-butyldimethylsilyloxy-3-(N'',N''-dimethylaminosulfonyl)phenyl]-N'-(2-bromophenyl)thiourea
Database identifiers
- PubChem CID
- 23447779
Properties
Computed structural properties
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 758
Related reactions
2 records
Compound notes
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