N-(4-methyl-2-morpholin-4-yl-pentyl)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-(4-methyl-2-morpholin-4-yl-pentyl)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-(4-methyl-2-morpholino-pentyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4-methyl-2-(4-morpholinyl)pentyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-(4-methyl-2-morpholin-4-ylpentyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-(4-methyl-2-morpholino-pentyl)phthalazine-1-carboxamide Formula: C26H32N4O3 MolecularWeight: 448.55728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3)N4CCOCC4

Isomeric SMILES

CC(C)CC(CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3)N4CCOCC4

InChI

InChI=1S/C26H32N4O3/c1-19(2)16-21(29-12-14-33-15-13-29)17-27-25(31)24-22-10-6-7-11-23(22)26(32)30(28-24)18-20-8-4-3-5-9-20/h3-11,19,21H,12-18H2,1-2H3,(H,27,31)