1-(3-pyrrolidin-1-ylsulfonylphenyl)-3-(2-quinolin-5-ylpyrazol-3-yl)pyridazin-4-one

Systemtic Name: 1-(3-pyrrolidin-1-ylsulfonylphenyl)-3-(2-quinolin-5-ylpyrazol-3-yl)pyridazin-4-one Openeye Name: 1-(3-pyrrolidin-1-ylsulfonylphenyl)-3-[2-(5-quinolyl)pyrazol-3-yl]pyridazin-4-one CAS Name: 1-[3-(1-pyrrolidinylsulfonyl)phenyl]-3-[2-(5-quinolinyl)-3-pyrazolyl]-4-pyridazinone IUPAC Name: 1-(3-pyrrolidin-1-ylsulfonylphenyl)-3-(2-quinolin-5-ylpyrazol-3-yl)pyridazin-4-one Traditional Name: 1-(3-pyrrolidinosulfonylphenyl)-3-[2-(5-quinolyl)pyrazol-3-yl]pyridazin-4-one Formula: C26H22N6O3S MolecularWeight: 498.55628

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)N3C=CC(=O)C(=N3)C4=CC=NN4C5=CC=CC6=C5C=CC=N6

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)N3C=CC(=O)C(=N3)C4=CC=NN4C5=CC=CC6=C5C=CC=N6

InChI

InChI=1S/C26H22N6O3S/c33-25-12-17-31(19-6-3-7-20(18-19)36(34,35)30-15-1-2-16-30)29-26(25)24-11-14-28-32(24)23-10-4-9-22-21(23)8-5-13-27-22/h3-14,17-18H,1-2,15-16H2