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

Systemtic Name: 6-(4-fluorophenyl)-2-[[1-(2-thiophen-2-ylethanoyl)piperidin-4-yl]methyl]pyridazin-3-one Openeye Name: 6-(4-fluorophenyl)-2-[[1-[2-(2-thienyl)acetyl]-4-piperidyl]methyl]pyridazin-3-one CAS Name: 6-(4-fluorophenyl)-2-[[1-(1-oxo-2-thiophen-2-ylethyl)-4-piperidinyl]methyl]-3-pyridazinone IUPAC Name: 6-(4-fluorophenyl)-2-[[1-(2-thiophen-2-ylacetyl)piperidin-4-yl]methyl]pyridazin-3-one Traditional Name: 6-(4-fluorophenyl)-2-[[1-[2-(2-thienyl)acetyl]-4-piperidyl]methyl]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=C(C=C3)F)C(=O)CC4=CC=CS4

Isomeric SMILES

C1CN(CCC1CN2C(=O)C=CC(=N2)C3=CC=C(C=C3)F)C(=O)CC4=CC=CS4

InChI

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