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Name: [4-amino-2-(piperidin-4-ylamino)-pyrimidin-5-yl]-(5-fluoro-2-methoxy-phenyl)-methanone trifluoroacetic acid salt

IUPAC: [4-amino-2-(piperidin-4-ylamino)pyrimidin-5-yl]-(5-fluoro-2-methoxyphenyl)methanone;2,2,2-trifluoroacetic acid

SMILES: COc1ccc(F)cc1C(=O)c1cnc(NC2CCNCC2)nc1N.O=C(O)C(F)(F)F

Canonical SMILES: COC1=C(C=C(C=C1)F)C(=O)C2=CN=C(N=C2N)NC3CCNCC3.C(=O)(C(F)(F)F)O

Summenformel: C19H21F4N5O4

Molare Masse: 459.40

InChIKey: OJFGAXVIUSQCTG-UHFFFAOYSA-N

InChI: InChI=1S/C17H20FN5O2.C2HF3O2/c1-25-14-3-2-10(18)8-12(14)15(24)13-9-21-17(23-16(13)19)22-11-4-6-20-7-5-11;3-2(4,5)1(6)7/h2-3,8-9,11,20H,4-7H2,1H3,(H3,19,21,22,23);(H,6,7)

PubChem CID: 21070627 →

Synonyme

[4-amino-2-(piperidin4-ylamino)-pyrimidin-5-yl]-(5-fluoro-2-methoxy-phenyl)-methanone trifluoroacetic acid saltSCHEMBL3840113[4-amino-2-(piperidin-4-ylamino)-pyrimidin-5-yl]-(5-fluoro-2-methoxy-phenyl)-methanone trifluoroacetic acid salt

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