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CHEBI:49569 - (3R,4S)-1-{6-[3-(METHYLSULFONYL)PHENYL]PYRIMIDIN-4-YL}-4-(2,4,5-TRIFLUOROPHENYL)PYRROLIDIN-3-AMINE

Default Structure
ChEBI IDCHEBI:49569
ChEBI Name(3R,4S)-1-{6-[3-(METHYLSULFONYL)PHENYL]PYRIMIDIN-4-YL}-4-(2,4,5-TRIFLUOROPHENYL)PYRROLIDIN-3-AMINE
Stars
DownloadsMolfile
FormulaC21H19F3N4O2S
Net Charge0
Average Mass448.470
Monoisotopic Mass448.11808
SMILES[H]c1nc(-c2c([H])c([H])c([H])c(S(=O)(=O)C([H])([H])[H])c2[H])c([H])c(N2C([H])([H])[C@]([H])(c3c([H])c(F)c(F)c([H])c3F)[C@@]([H])(N([H])[H])C2([H])[H])n1
InChIInChI=1S/C21H19F3N4O2S/c1-31(29,30)13-4-2-3-12(5-13)20-8-21(27-11-26-20)28-9-15(19(25)10-28)14-6-17(23)18(24)7-16(14)22/h2-8,11,15,19H,9-10,25H2,1H3/t15-,19+/m1/s1
InChIKeyOAWGQHXWGXOUKV-BEFAXECRSA-N
ChEBI Ontology
Outgoing Relation(s)
(3R,4S)-1-{6-[3-(METHYLSULFONYL)PHENYL]PYRIMIDIN-4-YL}-4-(2,4,5-TRIFLUOROPHENYL)PYRROLIDIN-3-AMINE (CHEBI:49569) is a unclassifieds (CHEBI:27189)
Synonyms  Source
(3R,4S)-1-{6-[3-(methylsulfonyl)phenyl]pyrimidin-4-yl}-4-(2,4,5-trifluorophenyl)pyrrolidin-3-aminePDBeChem
(3R,4S)-1-{6-[3-(METHYLSULFONYL)PHENYL]PYRIMIDIN-4-YL}-4-(2,4,5-TRIFLUOROPHENYL)PYRROLIDIN-3-AMINEPDBeChem
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