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

Systemtic Name: N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[2-morpholino-5-(trifluoromethyl)phenyl]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: 4-keto-N-[2-morpholino-5-(trifluoromethyl)phenyl]-3-propyl-phthalazine-1-carboxamide Formula: C23H23F3N4O3 MolecularWeight: 460.44893

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4CCOCC4

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4CCOCC4

InChI

InChI=1S/C23H23F3N4O3/c1-2-9-30-22(32)17-6-4-3-5-16(17)20(28-30)21(31)27-18-14-15(23(24,25)26)7-8-19(18)29-10-12-33-13-11-29/h3-8,14H,2,9-13H2,1H3,(H,27,31)