4-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]benzenecarbonitrile

Systemtic Name: 4-[3-bromanyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]benzenecarbonitrile Openeye Name: 4-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]benzonitrile CAS Name: 4-[3-bromo-7-(3-pyridinylmethylamino)-5-pyrazolo[1,5-a]pyrimidinyl]benzonitrile IUPAC Name: 4-[3-bromo-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]benzonitrile Traditional Name: 4-[3-bromo-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]benzonitrile Formula: C19H13BrN6 MolecularWeight: 405.25072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC2=CC(=NC3=C(C=NN23)Br)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC(=CN=C1)CNC2=CC(=NC3=C(C=NN23)Br)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C19H13BrN6/c20-16-12-24-26-18(23-11-14-2-1-7-22-10-14)8-17(25-19(16)26)15-5-3-13(9-21)4-6-15/h1-8,10,12,23H,11H2