1-(1-imidazol-1-yl-3,3-dimethyl-butan-2-yl)-3-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-(1-imidazol-1-yl-3,3-dimethyl-butan-2-yl)-3-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]urea Openeye Name: 1-[1-(imidazol-1-ylmethyl)-2,2-dimethyl-propyl]-3-[2-morpholino-5-(trifluoromethyl)phenyl]urea CAS Name: 1-[1-(1-imidazolyl)-3,3-dimethylbutan-2-yl]-3-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]urea IUPAC Name: 1-(1-imidazol-1-yl-3,3-dimethylbutan-2-yl)-3-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]urea Traditional Name: 1-[1-(imidazol-1-ylmethyl)-2,2-dimethyl-propyl]-3-[2-morpholino-5-(trifluoromethyl)phenyl]urea Formula: C21H28F3N5O2 MolecularWeight: 439.47453

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CN1C=CN=C1)NC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3

Isomeric SMILES

CC(C)(C)C(CN1C=CN=C1)NC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3

InChI

InChI=1S/C21H28F3N5O2/c1-20(2,3)18(13-28-7-6-25-14-28)27-19(30)26-16-12-15(21(22,23)24)4-5-17(16)29-8-10-31-11-9-29/h4-7,12,14,18H,8-11,13H2,1-3H3,(H2,26,27,30)