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

Systemtic Name: azepan-1-yl-[1-(3-fluorophenyl)-3,6-dimethyl-pyrazolo[3,4-b]pyridin-4-yl]methanone Openeye Name: azepan-1-yl-[1-(3-fluorophenyl)-3,6-dimethyl-pyrazolo[3,4-b]pyridin-4-yl]methanone CAS Name: 1-azepanyl-[1-(3-fluorophenyl)-3,6-dimethyl-4-pyrazolo[3,4-b]pyridinyl]methanone IUPAC Name: azepan-1-yl-[1-(3-fluorophenyl)-3,6-dimethylpyrazolo[3,4-b]pyridin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(3-fluorophenyl)-3,6-dimethyl-pyrazolo[3,4-b]pyridin-4-yl]methanone Formula: C21H23FN4O MolecularWeight: 366.431923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C3=CC(=CC=C3)F)C)C(=C1)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=NC2=C(C(=NN2C3=CC(=CC=C3)F)C)C(=C1)C(=O)N4CCCCCC4

InChI

InChI=1S/C21H23FN4O/c1-14-12-18(21(27)25-10-5-3-4-6-11-25)19-15(2)24-26(20(19)23-14)17-9-7-8-16(22)13-17/h7-9,12-13H,3-6,10-11H2,1-2H3