N-[2-methoxy-5-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]-4-morpholin-4-yl-butane-1-sulfonamide

Systemtic Name: N-[2-methoxy-5-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]-4-morpholin-4-yl-butane-1-sulfonamide Openeye Name: N-[2-methoxy-5-(4-oxo-3H-phthalazin-1-yl)phenyl]-4-morpholino-butane-1-sulfonamide CAS Name: N-[2-methoxy-5-(4-oxo-3H-phthalazin-1-yl)phenyl]-4-(4-morpholinyl)-1-butanesulfonamide IUPAC Name: N-[2-methoxy-5-(4-oxo-3H-phthalazin-1-yl)phenyl]-4-morpholin-4-ylbutane-1-sulfonamide Traditional Name: N-[5-(4-keto-3H-phthalazin-1-yl)-2-methoxy-phenyl]-4-morpholino-butane-1-sulfonamide Formula: C23H28N4O5S MolecularWeight: 472.55722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NNC(=O)C3=CC=CC=C32)NS(=O)(=O)CCCCN4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NNC(=O)C3=CC=CC=C32)NS(=O)(=O)CCCCN4CCOCC4

InChI

InChI=1S/C23H28N4O5S/c1-31-21-9-8-17(22-18-6-2-3-7-19(18)23(28)25-24-22)16-20(21)26-33(29,30)15-5-4-10-27-11-13-32-14-12-27/h2-3,6-9,16,26H,4-5,10-15H2,1H3,(H,25,28)