5-[4-[(4-methoxy-3-piperidin-1-ylcarbonyl-phenyl)amino]phthalazin-1-yl]-2-methyl-N-(pyridin-3-ylmethyl)benzenesulfonamide

Systemtic Name: 5-[4-[(4-methoxy-3-piperidin-1-ylcarbonyl-phenyl)amino]phthalazin-1-yl]-2-methyl-N-(pyridin-3-ylmethyl)benzenesulfonamide Openeye Name: 5-[4-[4-methoxy-3-(piperidine-1-carbonyl)anilino]phthalazin-1-yl]-2-methyl-N-(3-pyridylmethyl)benzenesulfonamide CAS Name: 5-[4-[4-methoxy-3-[oxo(1-piperidinyl)methyl]anilino]-1-phthalazinyl]-2-methyl-N-(3-pyridinylmethyl)benzenesulfonamide IUPAC Name: 5-[4-[4-methoxy-3-(piperidine-1-carbonyl)anilino]phthalazin-1-yl]-2-methyl-N-(pyridin-3-ylmethyl)benzenesulfonamide Traditional Name: 5-[4-[4-methoxy-3-(piperidine-1-carbonyl)anilino]phthalazin-1-yl]-2-methyl-N-(3-pyridylmethyl)benzenesulfonamide Formula: C34H34N6O4S MolecularWeight: 622.73656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC(=C(C=C4)OC)C(=O)N5CCCCC5)S(=O)(=O)NCC6=CN=CC=C6

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC(=C(C=C4)OC)C(=O)N5CCCCC5)S(=O)(=O)NCC6=CN=CC=C6

InChI

InChI=1S/C34H34N6O4S/c1-23-12-13-25(19-31(23)45(42,43)36-22-24-9-8-16-35-21-24)32-27-10-4-5-11-28(27)33(39-38-32)37-26-14-15-30(44-2)29(20-26)34(41)40-17-6-3-7-18-40/h4-5,8-16,19-21,36H,3,6-7,17-18,22H2,1-2H3,(H,37,39)