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

Systemtic Name: 2-[[1-[2-(3-methoxyphenyl)ethanoyl]piperidin-4-yl]methyl]-6-thiophen-2-yl-pyridazin-3-one Openeye Name: 2-[[1-[2-(3-methoxyphenyl)acetyl]-4-piperidyl]methyl]-6-(2-thienyl)pyridazin-3-one CAS Name: 2-[[1-[2-(3-methoxyphenyl)-1-oxoethyl]-4-piperidinyl]methyl]-6-thiophen-2-yl-3-pyridazinone IUPAC Name: 2-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-6-thiophen-2-ylpyridazin-3-one Traditional Name: 2-[[1-[2-(3-methoxyphenyl)acetyl]-4-piperidyl]methyl]-6-(2-thienyl)pyridazin-3-one Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC(=O)N2CCC(CC2)CN3C(=O)C=CC(=N3)C4=CC=CS4

Isomeric SMILES

COC1=CC=CC(=C1)CC(=O)N2CCC(CC2)CN3C(=O)C=CC(=N3)C4=CC=CS4

InChI

InChI=1S/C23H25N3O3S/c1-29-19-5-2-4-18(14-19)15-23(28)25-11-9-17(10-12-25)16-26-22(27)8-7-20(24-26)21-6-3-13-30-21/h2-8,13-14,17H,9-12,15-16H2,1H3