2-(4-fluorophenyl)-6-[4-[2-(furan-2-yl)quinolin-4-yl]carbonylpiperazin-1-yl]pyridazin-3-one

Systemtic Name: 2-(4-fluorophenyl)-6-[4-[2-(furan-2-yl)quinolin-4-yl]carbonylpiperazin-1-yl]pyridazin-3-one Openeye Name: 2-(4-fluorophenyl)-6-[4-[2-(2-furyl)quinoline-4-carbonyl]piperazin-1-yl]pyridazin-3-one CAS Name: 2-(4-fluorophenyl)-6-[4-[[2-(2-furanyl)-4-quinolinyl]-oxomethyl]-1-piperazinyl]-3-pyridazinone IUPAC Name: 2-(4-fluorophenyl)-6-[4-[2-(furan-2-yl)quinoline-4-carbonyl]piperazin-1-yl]pyridazin-3-one Traditional Name: 2-(4-fluorophenyl)-6-[4-[2-(2-furyl)quinoline-4-carbonyl]piperazino]pyridazin-3-one Formula: C28H22FN5O3 MolecularWeight: 495.504383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN(C(=O)C=C2)C3=CC=C(C=C3)F)C(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CO6

Isomeric SMILES

C1CN(CCN1C2=NN(C(=O)C=C2)C3=CC=C(C=C3)F)C(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CO6

InChI

InChI=1S/C28H22FN5O3/c29-19-7-9-20(10-8-19)34-27(35)12-11-26(31-34)32-13-15-33(16-14-32)28(36)22-18-24(25-6-3-17-37-25)30-23-5-2-1-4-21(22)23/h1-12,17-18H,13-16H2