3-[(2-azanyl-4-bromanyl-phenyl)-(pyridin-3-ylmethyl)amino]propanenitrile

Systemtic Name: 3-[(2-azanyl-4-bromanyl-phenyl)-(pyridin-3-ylmethyl)amino]propanenitrile Openeye Name: 3-[2-amino-4-bromo-N-(3-pyridylmethyl)anilino]propanenitrile CAS Name: 3-[2-amino-4-bromo-N-(3-pyridinylmethyl)anilino]propanenitrile IUPAC Name: 3-[2-amino-4-bromo-N-(pyridin-3-ylmethyl)anilino]propanenitrile Traditional Name: 3-[2-amino-4-bromo-N-(3-pyridylmethyl)anilino]propionitrile Formula: C15H15BrN4 MolecularWeight: 331.2104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CN(CCC#N)C2=C(C=C(C=C2)Br)N

Isomeric SMILES

C1=CC(=CN=C1)CN(CCC#N)C2=C(C=C(C=C2)Br)N

InChI

InChI=1S/C15H15BrN4/c16-13-4-5-15(14(18)9-13)20(8-2-6-17)11-12-3-1-7-19-10-12/h1,3-5,7,9-10H,2,8,11,18H2