4-(2-bromanyl-3-cyano-phenyl)-6-(1-ethanoylpiperidin-4-yl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile

Systemtic Name: 4-(2-bromanyl-3-cyano-phenyl)-6-(1-ethanoylpiperidin-4-yl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile Openeye Name: 6-(1-acetyl-4-piperidyl)-4-(2-bromo-3-cyano-phenyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile CAS Name: 6-(1-acetyl-4-piperidinyl)-4-(2-bromo-3-cyanophenyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile IUPAC Name: 6-(1-acetylpiperidin-4-yl)-4-(2-bromo-3-cyanophenyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile Traditional Name: 6-(1-acetyl-4-piperidyl)-4-(2-bromo-3-cyano-phenyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile Formula: C21H19BrN6O MolecularWeight: 451.31916

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)C2=C(C(C3=CNNC3=N2)C4=CC=CC(=C4Br)C#N)C#N

Isomeric SMILES

CC(=O)N1CCC(CC1)C2=C(C(C3=CNNC3=N2)C4=CC=CC(=C4Br)C#N)C#N

InChI

InChI=1S/C21H19BrN6O/c1-12(29)28-7-5-13(6-8-28)20-16(10-24)18(17-11-25-27-21(17)26-20)15-4-2-3-14(9-23)19(15)22/h2-4,11,13,18H,5-8H2,1H3,(H2,25,26,27)