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

Systemtic Name: 2-bromanyl-3-(6-cyclopropyl-5-isocyano-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzenecarbonitrile Openeye Name: 2-bromo-3-(6-cyclopropyl-5-isocyano-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzonitrile CAS Name: 2-bromo-3-(6-cyclopropyl-5-isocyano-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzonitrile IUPAC Name: 2-bromo-3-(6-cyclopropyl-5-isocyano-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzonitrile Traditional Name: 2-bromo-3-(6-cyclopropyl-5-isocyano-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzonitrile Formula: C17H12BrN5 MolecularWeight: 366.21468

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=C(N=C2C(=CNN2)C1C3=CC=CC(=C3Br)C#N)C4CC4

Isomeric SMILES

[C-]#[N+]C1=C(N=C2C(=CNN2)C1C3=CC=CC(=C3Br)C#N)C4CC4

InChI

InChI=1S/C17H12BrN5/c1-20-16-13(11-4-2-3-10(7-19)14(11)18)12-8-21-23-17(12)22-15(16)9-5-6-9/h2-4,8-9,13H,5-6H2,(H2,21,22,23)