ethyl 4-[[6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[3,4-b]pyridin-4-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[3,4-b]pyridin-4-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[6-phenyl-1-(4-pyridylmethyl)pyrazolo[3,4-b]pyridine-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[oxo-[6-phenyl-1-(pyridin-4-ylmethyl)-4-pyrazolo[3,4-b]pyridinyl]methyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[3,4-b]pyridine-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[6-phenyl-1-(4-pyridylmethyl)pyrazolo[3,4-b]pyridine-4-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C27H28N6O3 MolecularWeight: 484.54962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC(=NC3=C2C=NN3CC4=CC=NC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC(=NC3=C2C=NN3CC4=CC=NC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H28N6O3/c1-2-36-27(35)32-14-10-21(11-15-32)30-26(34)22-16-24(20-6-4-3-5-7-20)31-25-23(22)17-29-33(25)18-19-8-12-28-13-9-19/h3-9,12-13,16-17,21H,2,10-11,14-15,18H2,1H3,(H,30,34)