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

Systemtic Name: N-(3-ethyl-2-morpholin-4-yl-pentyl)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-(3-ethyl-2-morpholino-pentyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-[3-ethyl-2-(4-morpholinyl)pentyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-(3-ethyl-2-morpholin-4-ylpentyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-(3-ethyl-2-morpholino-pentyl)-4-keto-phthalazine-1-carboxamide Formula: C27H34N4O3 MolecularWeight: 462.58386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H34N4O3/c1-3-21(4-2)24(30-14-16-34-17-15-30)18-28-26(32)25-22-12-8-9-13-23(22)27(33)31(29-25)19-20-10-6-5-7-11-20/h5-13,21,24H,3-4,14-19H2,1-2H3,(H,28,32)