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CHEBI:99647 - N-[(2S,3S)-4-[[(2R)-1-hydroxypropan-2-yl]-[oxo-[4-(trifluoromethyl)anilino]methyl]amino]-2-methoxy-3-methylbutyl]-N-methylcyclopropanecarboxamide

ChEBI IDCHEBI:99647
ChEBI NameN-[(2S,3S)-4-[[(2R)-1-hydroxypropan-2-yl]-[oxo-[4-(trifluoromethyl)anilino]methyl]amino]-2-methoxy-3-methylbutyl]-N-methylcyclopropanecarboxamide
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DownloadsMolfile
FormulaC22H32F3N3O4
Net Charge0
Average Mass459.509
Monoisotopic Mass459.23449
SMILESCO[C@H](CN(C)C(=O)C1CC1)[C@@H](C)CN(C(=O)Nc1ccc(C(F)(F)F)cc1)[C@H](C)CO
InChIInChI=1S/C22H32F3N3O4/c1-14(19(32-4)12-27(3)20(30)16-5-6-16)11-28(15(2)13-29)21(31)26-18-9-7-17(8-10-18)22(23,24)25/h7-10,14-16,19,29H,5-6,11-13H2,1-4H3,(H,26,31)/t14-,15+,19+/m0/s1
InChIKeyGUZASBNVYSIPQO-QMTMVMCOSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3S)-4-[[(2R)-1-hydroxypropan-2-yl]-[oxo-[4-(trifluoromethyl)anilino]methyl]amino]-2-methoxy-3-methylbutyl]-N-methylcyclopropanecarboxamide (CHEBI:99647) is a ureas (CHEBI:47857)
Manual XrefsDatabases
LSM-11026LINCS