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

Systemtic Name: N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[2-morpholino-5-(trifluoromethyl)phenyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: 4-keto-N-[2-morpholino-5-(trifluoromethyl)phenyl]-3-phenyl-phthalazine-1-carboxamide Formula: C26H21F3N4O3 MolecularWeight: 494.46515

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C26H21F3N4O3/c27-26(28,29)17-10-11-22(32-12-14-36-15-13-32)21(16-17)30-24(34)23-19-8-4-5-9-20(19)25(35)33(31-23)18-6-2-1-3-7-18/h1-11,16H,12-15H2,(H,30,34)