2-bromanyl-3-(6-propyl-5-pyridin-2-yl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzenecarbonitrile

Systemtic Name: 2-bromanyl-3-(6-propyl-5-pyridin-2-yl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzenecarbonitrile Openeye Name: 2-bromo-3-[6-propyl-5-(2-pyridyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl]benzonitrile CAS Name: 2-bromo-3-[6-propyl-5-(2-pyridinyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl]benzonitrile IUPAC Name: 2-bromo-3-(6-propyl-5-pyridin-2-yl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzonitrile Traditional Name: 2-bromo-3-[6-propyl-5-(2-pyridyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl]benzonitrile Formula: C21H18BrN5 MolecularWeight: 420.30512

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(C2=CNNC2=N1)C3=CC=CC(=C3Br)C#N)C4=CC=CC=N4

Isomeric SMILES

CCCC1=C(C(C2=CNNC2=N1)C3=CC=CC(=C3Br)C#N)C4=CC=CC=N4

InChI

InChI=1S/C21H18BrN5/c1-2-6-17-19(16-9-3-4-10-24-16)18(15-12-25-27-21(15)26-17)14-8-5-7-13(11-23)20(14)22/h3-5,7-10,12,18H,2,6H2,1H3,(H2,25,26,27)