3-[2-(6-chloranylquinolin-4-yl)pyrazol-3-yl]-1-(3-piperidin-1-ylsulfonylphenyl)pyridazin-4-one

Systemtic Name: 3-[2-(6-chloranylquinolin-4-yl)pyrazol-3-yl]-1-(3-piperidin-1-ylsulfonylphenyl)pyridazin-4-one Openeye Name: 3-[2-(6-chloro-4-quinolyl)pyrazol-3-yl]-1-[3-(1-piperidylsulfonyl)phenyl]pyridazin-4-one CAS Name: 3-[2-(6-chloro-4-quinolinyl)-3-pyrazolyl]-1-[3-(1-piperidinylsulfonyl)phenyl]-4-pyridazinone IUPAC Name: 3-[2-(6-chloroquinolin-4-yl)pyrazol-3-yl]-1-(3-piperidin-1-ylsulfonylphenyl)pyridazin-4-one Traditional Name: 3-[2-(6-chloro-4-quinolyl)pyrazol-3-yl]-1-(3-piperidinosulfonylphenyl)pyridazin-4-one Formula: C27H23ClN6O3S MolecularWeight: 547.02792

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)N3C=CC(=O)C(=N3)C4=CC=NN4C5=C6C=C(C=CC6=NC=C5)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)N3C=CC(=O)C(=N3)C4=CC=NN4C5=C6C=C(C=CC6=NC=C5)Cl

InChI

InChI=1S/C27H23ClN6O3S/c28-19-7-8-23-22(17-19)24(9-12-29-23)34-25(10-13-30-34)27-26(35)11-16-33(31-27)20-5-4-6-21(18-20)38(36,37)32-14-2-1-3-15-32/h4-13,16-18H,1-3,14-15H2