azepan-1-yl-[4-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazolo[3,4-b]pyridin-5-yl]methanone

Systemtic Name: azepan-1-yl-[4-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazolo[3,4-b]pyridin-5-yl]methanone Openeye Name: azepan-1-yl-[4-chloro-1-(4-fluorophenyl)-3-methyl-pyrazolo[3,4-b]pyridin-5-yl]methanone CAS Name: 1-azepanyl-[4-chloro-1-(4-fluorophenyl)-3-methyl-5-pyrazolo[3,4-b]pyridinyl]methanone IUPAC Name: azepan-1-yl-[4-chloro-1-(4-fluorophenyl)-3-methylpyrazolo[3,4-b]pyridin-5-yl]methanone Traditional Name: azepan-1-yl-[4-chloro-1-(4-fluorophenyl)-3-methyl-pyrazolo[3,4-b]pyridin-5-yl]methanone Formula: C20H20ClFN4O MolecularWeight: 386.850403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C(=C12)Cl)C(=O)N3CCCCCC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NN(C2=NC=C(C(=C12)Cl)C(=O)N3CCCCCC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H20ClFN4O/c1-13-17-18(21)16(20(27)25-10-4-2-3-5-11-25)12-23-19(17)26(24-13)15-8-6-14(22)7-9-15/h6-9,12H,2-5,10-11H2,1H3