Record Information
Version1.0
Creation Date2026-04-03 02:34:23 UTC
Update Date2026-04-03 02:34:23 UTC
Accession NumberCHEM060410
Identification
Common NameN1-imino(phenyl)methyl-3,5-bis(trifluoromethyl)benzene-1-sulfonamide
ClassSmall Molecule
DescriptionN1-imino(phenyl)methyl-3,5-bis(trifluoromethyl)benzene-1-sulfonamide belongs to the benzenesulfonamides, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the chemical formula C15H10F6N2O2S1.
Contaminant SourcesNot Available
Contaminant TypeNot Available
Chemical Structure
Thumb
SynonymsNot Available
Chemical FormulaC15H10F6N2O2S1
Average Molecular MassNot Available
Monoisotopic Mass396.037 g/mol
CAS Registry NumberNot Available
IUPAC NameN'-[3,5-bis(trifluoromethyl)phenyl]sulfonylbenzenecarboximidamide
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C15H10F6N2O2S/c16-14(17,18)10-6-11(15(19,20)21)8-12(7-10)26(24,25)23-13(22)9-4-2-1-3-5-9/h1-8H,(H2,22,23)
InChI KeyMRLJNOVOXJRVDJ-UHFFFAOYSA-N
Chemical Taxonomy
Description belongs to the class of organic compounds known as benzenesulfonamides. These are organic compounds containing a sulfonamide group that is S-linked to a benzene ring.
KingdomOrganic compounds
Super ClassBenzenoids
ClassBenzene and substituted derivatives
Sub ClassBenzenesulfonamides
Direct ParentBenzenesulfonamides
Alternative Parents
Substituents
  • Benzenesulfonamide
  • Trifluoromethylbenzene
  • Benzenesulfonyl group
  • Sulfonyl
  • Organosulfonic acid or derivatives
  • Organic sulfonic acid or derivatives
  • Amidine
  • Organic oxygen compound
  • Organic oxide
  • Alkyl fluoride
  • Hydrocarbon derivative
  • Organosulfur compound
  • Organonitrogen compound
  • Organofluoride
  • Organohalogen compound
  • Organic nitrogen compound
  • Alkyl halide
  • Organopnictogen compound
  • Aromatic homomonocyclic compound
Molecular FrameworkAromatic homomonocyclic compounds
External DescriptorsNot Available
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
PathwaysNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted PropertiesNot Available
Spectra
SpectraNot Available
Toxicity Profile
Route of ExposureNot Available
Mechanism of ToxicityNot Available
MetabolismNot Available
Toxicity ValuesNot Available
Lethal DoseNot Available
Carcinogenicity (IARC Classification)Not Available
Uses/SourcesNot Available
Minimum Risk LevelNot Available
Health EffectsNot Available
SymptomsNot Available
TreatmentNot Available
Concentrations
Not Available
DrugBank IDNot Available
HMDB IDNot Available
FooDB IDNot Available
Phenol Explorer IDNot Available
KNApSAcK IDNot Available
BiGG IDNot Available
BioCyc IDNot Available
METLIN IDNot Available
PDB IDNot Available
Wikipedia LinkNot Available
Chemspider IDNot Available
ChEBI IDNot Available
PubChem Compound ID2804018
Kegg Compound IDNot Available
YMDB IDNot Available
ECMDB IDNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available