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

Systemtic Name: 2-bromanyl-3-(5-isocyano-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzenecarbonitrile Openeye Name: 2-bromo-3-(5-isocyano-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzonitrile CAS Name: 2-bromo-3-(5-isocyano-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzonitrile IUPAC Name: 2-bromo-3-(5-isocyano-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzonitrile Traditional Name: 2-bromo-3-(5-isocyano-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzonitrile Formula: C17H14BrN5 MolecularWeight: 368.23056

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(C2=CNNC2=N1)C3=CC=CC(=C3Br)C#N)[N+]#[C-]

Isomeric SMILES

CCCC1=C(C(C2=CNNC2=N1)C3=CC=CC(=C3Br)C#N)[N+]#[C-]

InChI

InChI=1S/C17H14BrN5/c1-3-5-13-16(20-2)14(12-9-21-23-17(12)22-13)11-7-4-6-10(8-19)15(11)18/h4,6-7,9,14H,3,5H2,1H3,(H2,21,22,23)