N-(2-morpholin-4-yl-2-phenyl-ethyl)-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-(2-morpholin-4-yl-2-phenyl-ethyl)-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-(2-morpholino-2-phenyl-ethyl)-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[2-(4-morpholinyl)-2-phenylethyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-(2-morpholin-4-yl-2-phenylethyl)-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-(2-morpholino-2-phenyl-ethyl)phthalazine-1-carboxamide Formula: C26H32N4O3 MolecularWeight: 448.55728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32N4O3/c1-2-3-9-14-30-26(32)22-13-8-7-12-21(22)24(28-30)25(31)27-19-23(20-10-5-4-6-11-20)29-15-17-33-18-16-29/h4-8,10-13,23H,2-3,9,14-19H2,1H3,(H,27,31)