N-(4-bromanyl-2-fluoranyl-phenyl)-2-(3-methyl-4-phenyl-pyrazolo[3,4-b]pyridin-1-yl)ethanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-(3-methyl-4-phenyl-pyrazolo[3,4-b]pyridin-1-yl)ethanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-(3-methyl-4-phenyl-pyrazolo[3,4-b]pyridin-1-yl)acetamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-(3-methyl-4-phenyl-1-pyrazolo[3,4-b]pyridinyl)acetamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-(3-methyl-4-phenylpyrazolo[3,4-b]pyridin-1-yl)acetamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-(3-methyl-4-phenyl-pyrazolo[3,4-b]pyridin-1-yl)acetamide Formula: C21H16BrFN4O MolecularWeight: 439.280343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=CC(=C12)C3=CC=CC=C3)CC(=O)NC4=C(C=C(C=C4)Br)F

Isomeric SMILES

CC1=NN(C2=NC=CC(=C12)C3=CC=CC=C3)CC(=O)NC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C21H16BrFN4O/c1-13-20-16(14-5-3-2-4-6-14)9-10-24-21(20)27(26-13)12-19(28)25-18-8-7-15(22)11-17(18)23/h2-11H,12H2,1H3,(H,25,28)