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

Systemtic Name: 3-butyl-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-butyl-N-[2-morpholino-5-(trifluoromethyl)phenyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-butyl-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-butyl-4-keto-N-[2-morpholino-5-(trifluoromethyl)phenyl]phthalazine-1-carboxamide Formula: C24H25F3N4O3 MolecularWeight: 474.47551

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4CCOCC4

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4CCOCC4

InChI

InChI=1S/C24H25F3N4O3/c1-2-3-10-31-23(33)18-7-5-4-6-17(18)21(29-31)22(32)28-19-15-16(24(25,26)27)8-9-20(19)30-11-13-34-14-12-30/h4-9,15H,2-3,10-14H2,1H3,(H,28,32)