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

Systemtic Name: tert-butyl 4-(1,3-dimethyl-6-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl)carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(6-isopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridine-4-carbonyl)piperazine-1-carboxylate CAS Name: 4-[(1,3-dimethyl-6-propan-2-yl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1,3-dimethyl-6-propan-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(6-isopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridine-4-carbonyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C21H31N5O3 MolecularWeight: 401.50254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C(C)C)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C(C)C)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C21H31N5O3/c1-13(2)16-12-15(17-14(3)23-24(7)18(17)22-16)19(27)25-8-10-26(11-9-25)20(28)29-21(4,5)6/h12-13H,8-11H2,1-7H3