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

Systemtic Name: [4-[1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidin-1-yl]-pyridin-3-yl-methanone Openeye Name: [4-[1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxy-1-piperidyl]-(3-pyridyl)methanone CAS Name: [4-[[1-(4-methylsulfonylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]oxy]-1-piperidinyl]-(3-pyridinyl)methanone IUPAC Name: [4-[1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidin-1-yl]-pyridin-3-ylmethanone Traditional Name: [4-[1-(4-mesylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidino]-(3-pyridyl)methanone Formula: C23H22N6O4S MolecularWeight: 478.52358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22N6O4S/c1-34(31,32)19-6-4-17(5-7-19)29-21-20(14-27-29)22(26-15-25-21)33-18-8-11-28(12-9-18)23(30)16-3-2-10-24-13-16/h2-7,10,13-15,18H,8-9,11-12H2,1H3