4-[(6-bromanylpyridin-3-yl)methyl-pyrimidin-5-yl-amino]benzenecarbonitrile

Systemtic Name: 4-[(6-bromanylpyridin-3-yl)methyl-pyrimidin-5-yl-amino]benzenecarbonitrile Openeye Name: 4-[(6-bromo-3-pyridyl)methyl-pyrimidin-5-yl-amino]benzonitrile CAS Name: 4-[(6-bromo-3-pyridinyl)methyl-(5-pyrimidinyl)amino]benzonitrile IUPAC Name: 4-[(6-bromopyridin-3-yl)methyl-pyrimidin-5-ylamino]benzonitrile Traditional Name: 4-[(6-bromo-3-pyridyl)methyl-(5-pyrimidyl)amino]benzonitrile Formula: C17H12BrN5 MolecularWeight: 366.21468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)N(CC2=CN=C(C=C2)Br)C3=CN=CN=C3

Isomeric SMILES

C1=CC(=CC=C1C#N)N(CC2=CN=C(C=C2)Br)C3=CN=CN=C3

InChI

InChI=1S/C17H12BrN5/c18-17-6-3-14(8-22-17)11-23(16-9-20-12-21-10-16)15-4-1-13(7-19)2-5-15/h1-6,8-10,12H,11H2