2-[4-[1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidin-1-yl]-1-pyridin-3-yl-ethanone

Systemtic Name: 2-[4-[1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidin-1-yl]-1-pyridin-3-yl-ethanone Openeye Name: 2-[4-[1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxy-1-piperidyl]-1-(3-pyridyl)ethanone CAS Name: 2-[4-[[1-(4-methylsulfonylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]oxy]-1-piperidinyl]-1-(3-pyridinyl)ethanone IUPAC Name: 2-[4-[1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidin-1-yl]-1-pyridin-3-ylethanone Traditional Name: 2-[4-[1-(4-mesylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidino]-1-(3-pyridyl)ethanone Formula: C24H24N6O4S MolecularWeight: 492.55016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)OC4CCN(CC4)CC(=O)C5=CN=CC=C5

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)OC4CCN(CC4)CC(=O)C5=CN=CC=C5

InChI

InChI=1S/C24H24N6O4S/c1-35(32,33)20-6-4-18(5-7-20)30-23-21(14-28-30)24(27-16-26-23)34-19-8-11-29(12-9-19)15-22(31)17-3-2-10-25-13-17/h2-7,10,13-14,16,19H,8-9,11-12,15H2,1H3