1-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-3-[4-(trifluoromethyl)phenyl]urea

Properties Image MNX_ID MNXM339173 reference chebi:119018 formula C21H26F3N3O4 global charge 0 mol weight 441.45 InChIKey WYLNQZCZILOHII-KSZLIROESA-N InChI InChI=1S/C21H26F3N3O4/c22-21(23,24)14-4-6-15(7-5-14)25-20(30)26-17-9-8-16(31-18(17)13-28)12-19(29)27-10-2-1-3-11-27/h4-9,16-18,28H,1-3,10-13H2,(H2,25,26,30)/t16-,17+,18-/m0/s1 SMILES O=C(NC1=CC=C(C(F)(F)F)C=C1)N[C@@H]1C=C[C@@H](CC(=O)N2CCCCC2)O[C@H]1CO MNX internals InChI (mnx) InChI=1/C21H26F3N3O4/c22-21(23,24)14-4-6-15(7-5-14)25-20(30)26-17-9-8-16(31-18(17)13-28)12-19(29)27-10-2-1-3-11-27/h4-9,16-18,28H,1-3,10-13H2,(H2,25,26,30)/t16-,17+,18-/m0/s1 SMILES (mnx) [CH2:1]1[CH2:2][CH2:10][N:27]([C:19]([CH2:12][C@@H:16]2[CH:8]=[CH:9][C@@H:17]([N:26]=[C:20]([NH:25][C:15]3=[CH:7][CH:5]=[C:14]([C:21]([F:22])([F:23])[F:24])[CH:4]=[CH:6]3)[OH:30])[C@H:18]([CH2:13][OH:28])[O:31]2)=[O:29])[CH2:11][CH2:3]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0