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

Systemtic Name: 2-bromanyl-3-(6-tert-butyl-5-isocyano-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzenecarbonitrile Openeye Name: 2-bromo-3-(6-tert-butyl-5-isocyano-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzonitrile CAS Name: 2-bromo-3-(6-tert-butyl-5-isocyano-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzonitrile IUPAC Name: 2-bromo-3-(6-tert-butyl-5-isocyano-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzonitrile Traditional Name: 2-bromo-3-(6-tert-butyl-5-isocyano-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzonitrile Formula: C18H16BrN5 MolecularWeight: 382.25714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(C2=CNNC2=N1)C3=CC=CC(=C3Br)C#N)[N+]#[C-]

Isomeric SMILES

CC(C)(C)C1=C(C(C2=CNNC2=N1)C3=CC=CC(=C3Br)C#N)[N+]#[C-]

InChI

InChI=1S/C18H16BrN5/c1-18(2,3)16-15(21-4)13(12-9-22-24-17(12)23-16)11-7-5-6-10(8-20)14(11)19/h5-7,9,13H,1-3H3,(H2,22,23,24)