propan-2-yl 4-[4-(2-methyl-6-methylsulfonyl-pyridin-3-yl)oxypyrazolo[3,4-d]pyrimidin-1-yl]piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[4-(2-methyl-6-methylsulfonyl-pyridin-3-yl)oxypyrazolo[3,4-d]pyrimidin-1-yl]piperidine-1-carboxylate Openeye Name: isopropyl 4-[4-[(2-methyl-6-methylsulfonyl-3-pyridyl)oxy]pyrazolo[3,4-d]pyrimidin-1-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(2-methyl-6-methylsulfonyl-3-pyridinyl)oxy]-1-pyrazolo[3,4-d]pyrimidinyl]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[4-(2-methyl-6-methylsulfonylpyridin-3-yl)oxypyrazolo[3,4-d]pyrimidin-1-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(6-mesyl-2-methyl-3-pyridyl)oxy]pyrazolo[3,4-d]pyrimidin-1-yl]piperidine-1-carboxylic acid isopropyl ester Formula: C21H26N6O5S MolecularWeight: 474.53334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)S(=O)(=O)C)OC2=NC=NC3=C2C=NN3C4CCN(CC4)C(=O)OC(C)C

Isomeric SMILES

CC1=C(C=CC(=N1)S(=O)(=O)C)OC2=NC=NC3=C2C=NN3C4CCN(CC4)C(=O)OC(C)C

InChI

InChI=1S/C21H26N6O5S/c1-13(2)31-21(28)26-9-7-15(8-10-26)27-19-16(11-24-27)20(23-12-22-19)32-17-5-6-18(25-14(17)3)33(4,29)30/h5-6,11-13,15H,7-10H2,1-4H3