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

Systemtic Name: tert-butyl 4-(6-phenyl-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl)carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(1-isopropyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carbonyl)piperazine-1-carboxylate CAS Name: 4-[oxo-(6-phenyl-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinyl)methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(6-phenyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(1-isopropyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carbonyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C25H31N5O3 MolecularWeight: 449.54534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CC=C3)C(=O)N4CCN(CC4)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CC=C3)C(=O)N4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C25H31N5O3/c1-17(2)30-22-20(16-26-30)19(15-21(27-22)18-9-7-6-8-10-18)23(31)28-11-13-29(14-12-28)24(32)33-25(3,4)5/h6-10,15-17H,11-14H2,1-5H3