azepan-1-yl-[3-cyclopropyl-6-ethyl-1-(4-fluorophenyl)pyrazolo[3,4-b]pyridin-4-yl]methanone

Systemtic Name: azepan-1-yl-[3-cyclopropyl-6-ethyl-1-(4-fluorophenyl)pyrazolo[3,4-b]pyridin-4-yl]methanone Openeye Name: azepan-1-yl-[3-cyclopropyl-6-ethyl-1-(4-fluorophenyl)pyrazolo[3,4-b]pyridin-4-yl]methanone CAS Name: 1-azepanyl-[3-cyclopropyl-6-ethyl-1-(4-fluorophenyl)-4-pyrazolo[3,4-b]pyridinyl]methanone IUPAC Name: azepan-1-yl-[3-cyclopropyl-6-ethyl-1-(4-fluorophenyl)pyrazolo[3,4-b]pyridin-4-yl]methanone Traditional Name: azepan-1-yl-[3-cyclopropyl-6-ethyl-1-(4-fluorophenyl)pyrazolo[3,4-b]pyridin-4-yl]methanone Formula: C24H27FN4O MolecularWeight: 406.495783

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=C1)C(=O)N3CCCCCC3)C(=NN2C4=CC=C(C=C4)F)C5CC5

Isomeric SMILES

CCC1=NC2=C(C(=C1)C(=O)N3CCCCCC3)C(=NN2C4=CC=C(C=C4)F)C5CC5

InChI

InChI=1S/C24H27FN4O/c1-2-18-15-20(24(30)28-13-5-3-4-6-14-28)21-22(16-7-8-16)27-29(23(21)26-18)19-11-9-17(25)10-12-19/h9-12,15-16H,2-8,13-14H2,1H3