tert-butyl 4-[3,6-dimethyl-1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[3,6-dimethyl-1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidine-1-carboxylate Openeye Name: tert-butyl 4-[3,6-dimethyl-1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidine-1-carboxylate CAS Name: 4-[[3,6-dimethyl-1-(4-methylsulfonylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]oxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3,6-dimethyl-1-(4-methylsulfonylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidine-1-carboxylate Traditional Name: 4-[1-(4-mesylphenyl)-3,6-dimethyl-pyrazolo[3,4-d]pyrimidin-4-yl]oxypiperidine-1-carboxylic acid tert-butyl ester Formula: C24H31N5O5S MolecularWeight: 501.59844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=NC(=N2)C)OC3CCN(CC3)C(=O)OC(C)(C)C)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC1=NN(C2=C1C(=NC(=N2)C)OC3CCN(CC3)C(=O)OC(C)(C)C)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C24H31N5O5S/c1-15-20-21(29(27-15)17-7-9-19(10-8-17)35(6,31)32)25-16(2)26-22(20)33-18-11-13-28(14-12-18)23(30)34-24(3,4)5/h7-10,18H,11-14H2,1-6H3