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

Systemtic Name: tert-butyl 4-(6-cyclopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridin-4-yl)carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(6-cyclopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridine-4-carbonyl)piperazine-1-carboxylate CAS Name: 4-[(6-cyclopropyl-1,3-dimethyl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(6-cyclopropyl-1,3-dimethylpyrazolo[3,4-b]pyridine-4-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(6-cyclopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridine-4-carbonyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)N4CCN(CC4)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)N4CCN(CC4)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C21H29N5O3/c1-13-17-15(12-16(14-6-7-14)22-18(17)24(5)23-13)19(27)25-8-10-26(11-9-25)20(28)29-21(2,3)4/h12,14H,6-11H2,1-5H3