2-[[1-[2-(4-fluorophenyl)ethanoyl]piperidin-4-yl]methyl]-6-thiophen-2-yl-pyridazin-3-one

Systemtic Name: 2-[[1-[2-(4-fluorophenyl)ethanoyl]piperidin-4-yl]methyl]-6-thiophen-2-yl-pyridazin-3-one Openeye Name: 2-[[1-[2-(4-fluorophenyl)acetyl]-4-piperidyl]methyl]-6-(2-thienyl)pyridazin-3-one CAS Name: 2-[[1-[2-(4-fluorophenyl)-1-oxoethyl]-4-piperidinyl]methyl]-6-thiophen-2-yl-3-pyridazinone IUPAC Name: 2-[[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]methyl]-6-thiophen-2-ylpyridazin-3-one Traditional Name: 2-[[1-[2-(4-fluorophenyl)acetyl]-4-piperidyl]methyl]-6-(2-thienyl)pyridazin-3-one Formula: C22H22FN3O2S MolecularWeight: 411.492383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2C(=O)C=CC(=N2)C3=CC=CS3)C(=O)CC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCC1CN2C(=O)C=CC(=N2)C3=CC=CS3)C(=O)CC4=CC=C(C=C4)F

InChI

InChI=1S/C22H22FN3O2S/c23-18-5-3-16(4-6-18)14-22(28)25-11-9-17(10-12-25)15-26-21(27)8-7-19(24-26)20-2-1-13-29-20/h1-8,13,17H,9-12,14-15H2