tert-Butyl {2-(dimethylsulphamoyl)-1-[3-(trifluoromethyl)phenyl]ethyl}carbamate

HCID 59536741
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Basic information

Standard SMILES
CN(C)S(=O)(=O)CC(NC(=O)OC(C)(C)C)c1cccc(C(F)(F)F)c1
InChIKey
RMPMBGUEPUUDNZ-UHFFFAOYSA-N
Molecular formula
C16H23F3N2O4S
Average molar mass
396.4 g/mol
Monoisotopic mass
396.13306288

Names & identifiers

Preferred name
tert-Butyl {2-(dimethylsulphamoyl)-1-[3-(trifluoromethyl)phenyl]ethyl}carbamate
IUPAC
tert-butyl N-[2-(dimethylsulfamoyl)-1-[3-(trifluoromethyl)phenyl]ethyl]carbamate

Names & synonyms

tert-Butyl {2-(dimethylsulphamoyl)-1-[3-(trifluoromethyl)phenyl]ethyl}carbamateSCHEMBL10217131

Database identifiers

PubChem CID
59536741

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
84.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
7
Heavy atoms
26

Related reactions

2 records
New reaction record

Compound notes

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