tert-butyl 4-[6-(2-methylphenyl)-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[6-(2-methylphenyl)-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[1-isopropyl-6-(o-tolyl)pyrazolo[3,4-b]pyridine-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[6-(2-methylphenyl)-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[6-(2-methylphenyl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-isopropyl-6-(o-tolyl)pyrazolo[3,4-b]pyridine-4-carbonyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C26H33N5O3 MolecularWeight: 463.57192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=C(C=NN3C(C)C)C(=C2)C(=O)N4CCN(CC4)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=C(C=NN3C(C)C)C(=C2)C(=O)N4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H33N5O3/c1-17(2)31-23-21(16-27-31)20(15-22(28-23)19-10-8-7-9-18(19)3)24(32)29-11-13-30(14-12-29)25(33)34-26(4,5)6/h7-10,15-17H,11-14H2,1-6H3