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CHEBI:39725 - (2R,3R)-3-{[3,5-BIS(TRIFLUOROMETHYL)PHENYL]AMINO}-2-CYANO-3-THIOXOPROPANAMIDE

Default Structure
ChEBI IDCHEBI:39725
ChEBI Name(2R,3R)-3-{[3,5-BIS(TRIFLUOROMETHYL)PHENYL]AMINO}-2-CYANO-3-THIOXOPROPANAMIDE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC12H9F6N3OS
Net Charge0
Average Mass357.279
Monoisotopic Mass357.03705
SMILES[H]S[C@@]([H])(N([H])c1c([H])c(C(F)(F)F)c([H])c(C(F)(F)F)c1[H])[C@@]([H])(C#N)C(=O)N([H])[H]
InChIInChI=1S/C12H9F6N3OS/c13-11(14,15)5-1-6(12(16,17)18)3-7(2-5)21-10(23)8(4-19)9(20)22/h1-3,8,10,21,23H,(H2,20,22)/t8-,10+/m0/s1
InChIKeyZTUMRSFHUOBXAC-WCBMZHEXSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,3R)-3-{[3,5-BIS(TRIFLUOROMETHYL)PHENYL]AMINO}-2-CYANO-3-THIOXOPROPANAMIDE (CHEBI:39725) is a unclassifieds (CHEBI:27189)
Synonyms  Source
(2R,3R)-3-{[3,5-bis(trifluoromethyl)phenyl]amino}-2-cyano-3-sulfanylpropanamidePDBeChem
(2R,3R)-3-{[3,5-BIS(TRIFLUOROMETHYL)PHENYL]AMINO}-2-CYANO-3-THIOXOPROPANAMIDEPDBeChem
Manual XrefsDatabases
221PDBeChem