3-ethyl-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-ethyl-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-ethyl-N-[2-morpholino-5-(trifluoromethyl)phenyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-ethyl-N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-ethyl-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-ethyl-4-keto-N-[2-morpholino-5-(trifluoromethyl)phenyl]phthalazine-1-carboxamide Formula: C22H21F3N4O3 MolecularWeight: 446.42235

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4CCOCC4

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4CCOCC4

InChI

InChI=1S/C22H21F3N4O3/c1-2-29-21(31)16-6-4-3-5-15(16)19(27-29)20(30)26-17-13-14(22(23,24)25)7-8-18(17)28-9-11-32-12-10-28/h3-8,13H,2,9-12H2,1H3,(H,26,30)