2-methyl-5-(4-morpholin-4-ylphthalazin-1-yl)-N-(pyridin-3-ylmethyl)benzenesulfonamide

Systemtic Name: 2-methyl-5-(4-morpholin-4-ylphthalazin-1-yl)-N-(pyridin-3-ylmethyl)benzenesulfonamide Openeye Name: 2-methyl-5-(4-morpholinophthalazin-1-yl)-N-(3-pyridylmethyl)benzenesulfonamide CAS Name: 2-methyl-5-[4-(4-morpholinyl)-1-phthalazinyl]-N-(3-pyridinylmethyl)benzenesulfonamide IUPAC Name: 2-methyl-5-(4-morpholin-4-ylphthalazin-1-yl)-N-(pyridin-3-ylmethyl)benzenesulfonamide Traditional Name: 2-methyl-5-(4-morpholinophthalazin-1-yl)-N-(3-pyridylmethyl)benzenesulfonamide Formula: C25H25N5O3S MolecularWeight: 475.5627

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)N4CCOCC4)S(=O)(=O)NCC5=CN=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)N4CCOCC4)S(=O)(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C25H25N5O3S/c1-18-8-9-20(15-23(18)34(31,32)27-17-19-5-4-10-26-16-19)24-21-6-2-3-7-22(21)25(29-28-24)30-11-13-33-14-12-30/h2-10,15-16,27H,11-14,17H2,1H3