3-[3-acetyl-4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1,1-diethylurea

Properties Image MNX_ID MNXM103629 reference chebi:94461 formula C20H33N3O4 global charge 0 mol weight 379.501 InChIKey JOATXPAWOHTVSZ-UHFFFAOYSA-N InChI InChI=1S/C20H33N3O4/c1-7-23(8-2)19(26)22-15-9-10-18(17(11-15)14(3)24)27-13-16(25)12-21-20(4,5)6/h9-11,16,21,25H,7-8,12-13H2,1-6H3,(H,22,26) SMILES CCN(CC)C(=O)NC1=CC(C(C)=O)=C(OCC(O)CNC(C)(C)C)C=C1 MNX internals InChI (mnx) InChI=1/C20H33N3O4/c1-7-23(8-2)19(26)22-15-9-10-18(17(11-15)14(3)24)27-13-16(25)12-21-20(4,5)6/h9-11,16,21,25H,7-8,12-13H2,1-6H3,(H,22,26)/t16? SMILES (mnx) [CH3:1][CH2:7][N:23]([CH2:8][CH3:2])[C:19](=[N:22][C:15]1=[CH:11][C:17]([C:14]([CH3:3])=[O:24])=[C:18]([O:27][CH2:13][CH:16]([CH2:12][NH:21][C:20]([CH3:4])([CH3:5])[CH3:6])[OH:25])[CH:10]=[CH:9]1)[OH:26]

Parent-child relations graph

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