5-[1-(5-ethanoylpyrimidin-2-yl)piperidin-4-yl]oxy-2-(4-methylsulfonylphenyl)pyridazin-3-one

Systemtic Name: 5-[1-(5-ethanoylpyrimidin-2-yl)piperidin-4-yl]oxy-2-(4-methylsulfonylphenyl)pyridazin-3-one Openeye Name: 5-[[1-(5-acetylpyrimidin-2-yl)-4-piperidyl]oxy]-2-(4-methylsulfonylphenyl)pyridazin-3-one CAS Name: 5-[[1-(5-acetyl-2-pyrimidinyl)-4-piperidinyl]oxy]-2-(4-methylsulfonylphenyl)-3-pyridazinone IUPAC Name: 5-[1-(5-acetylpyrimidin-2-yl)piperidin-4-yl]oxy-2-(4-methylsulfonylphenyl)pyridazin-3-one Traditional Name: 5-[[1-(5-acetylpyrimidin-2-yl)-4-piperidyl]oxy]-2-(4-mesylphenyl)pyridazin-3-one Formula: C22H23N5O5S MolecularWeight: 469.51352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN=C(N=C1)N2CCC(CC2)OC3=CC(=O)N(N=C3)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC(=O)C1=CN=C(N=C1)N2CCC(CC2)OC3=CC(=O)N(N=C3)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C22H23N5O5S/c1-15(28)16-12-23-22(24-13-16)26-9-7-18(8-10-26)32-19-11-21(29)27(25-14-19)17-3-5-20(6-4-17)33(2,30)31/h3-6,11-14,18H,7-10H2,1-2H3