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

Systemtic Name: tert-butyl 4-[6-(furan-2-yl)-1,3-dimethyl-pyrazolo[3,4-b]pyridin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[6-(2-furyl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[6-(2-furanyl)-1,3-dimethyl-4-pyrazolo[3,4-b]pyridinyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[6-(furan-2-yl)-1,3-dimethylpyrazolo[3,4-b]pyridine-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[6-(2-furyl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-4-carbonyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C22H27N5O4 MolecularWeight: 425.48088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CO3)C(=O)N4CCN(CC4)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CO3)C(=O)N4CCN(CC4)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C22H27N5O4/c1-14-18-15(13-16(17-7-6-12-30-17)23-19(18)25(5)24-14)20(28)26-8-10-27(11-9-26)21(29)31-22(2,3)4/h6-7,12-13H,8-11H2,1-5H3