CHEBI:93266 - 3-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]sulfamoyl]-2-thiophenecarboxylic acid methyl ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]sulfamoyl]-2-thiophenecarboxylic acid methyl ester
ChEBI ID CHEBI:93266
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C15H11F6NO5S2
Net Charge 0
Average Mass 463.375
Monoisotopic Mass 462.99828
InChI InChI=1S/C15H11F6NO5S2/c1-27-12(23)11-10(6-7-28-11)29(25,26)22-9-4-2-8(3-5-9)13(24,14(16,17)18)15(19,20)21/h2-7,22,24H,1H3
InChIKey ZGZXYXCRZXDIOI-UHFFFAOYSA-N
SMILES COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC=C(C=C2)C(C(F)(F)F)(C(F)(F)F)O
ChEBI Ontology
Outgoing 3-[[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]sulfamoyl]-2-thiophenecarboxylic acid methyl ester (CHEBI:93266) is a sulfonamide (CHEBI:35358)
Manual Xref Database
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