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

Systemtic Name: 3-methyl-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-N-[2-morpholino-5-(trifluoromethyl)phenyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[2-morpholino-5-(trifluoromethyl)phenyl]phthalazine-1-carboxamide Formula: C21H19F3N4O3 MolecularWeight: 432.39577

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4CCOCC4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4CCOCC4

InChI

InChI=1S/C21H19F3N4O3/c1-27-20(30)15-5-3-2-4-14(15)18(26-27)19(29)25-16-12-13(21(22,23)24)6-7-17(16)28-8-10-31-11-9-28/h2-7,12H,8-11H2,1H3,(H,25,29)