(E)-2-(1H-benzimidazol-2-yl)-1-morpholin-4-yl-3-[2-(trifluoromethyl)phenyl]prop-2-en-1-one

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-1-morpholin-4-yl-3-[2-(trifluoromethyl)phenyl]prop-2-en-1-one Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-1-morpholino-3-[2-(trifluoromethyl)phenyl]prop-2-en-1-one CAS Name: (E)-2-(1H-benzimidazol-2-yl)-1-(4-morpholinyl)-3-[2-(trifluoromethyl)phenyl]-2-propen-1-one IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-1-morpholin-4-yl-3-[2-(trifluoromethyl)phenyl]prop-2-en-1-one Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-1-morpholino-3-[2-(trifluoromethyl)phenyl]prop-2-en-1-one Formula: C21H18F3N3O2 MolecularWeight: 401.38173

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C(=CC2=CC=CC=C2C(F)(F)F)C3=NC4=CC=CC=C4N3

Isomeric SMILES

C1COCCN1C(=O)/C(=C/C2=CC=CC=C2C(F)(F)F)/C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H18F3N3O2/c22-21(23,24)16-6-2-1-5-14(16)13-15(20(28)27-9-11-29-12-10-27)19-25-17-7-3-4-8-18(17)26-19/h1-8,13H,9-12H2,(H,25,26)/b15-13+