N-(4-morpholin-4-ylphenyl)-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-(4-morpholin-4-ylphenyl)-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-(4-morpholinophenyl)-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[4-(4-morpholinyl)phenyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-(4-morpholin-4-ylphenyl)-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-(4-morpholinophenyl)phthalazine-1-carboxamide Formula: C24H28N4O3 MolecularWeight: 420.50412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)N4CCOCC4

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)N4CCOCC4

InChI

InChI=1S/C24H28N4O3/c1-2-3-6-13-28-24(30)21-8-5-4-7-20(21)22(26-28)23(29)25-18-9-11-19(12-10-18)27-14-16-31-17-15-27/h4-5,7-12H,2-3,6,13-17H2,1H3,(H,25,29)