3-[(2-azanyl-6-chloranyl-phenyl)-(pyridin-3-ylmethyl)amino]propanenitrile

Systemtic Name: 3-[(2-azanyl-6-chloranyl-phenyl)-(pyridin-3-ylmethyl)amino]propanenitrile Openeye Name: 3-[2-amino-6-chloro-N-(3-pyridylmethyl)anilino]propanenitrile CAS Name: 3-[2-amino-6-chloro-N-(3-pyridinylmethyl)anilino]propanenitrile IUPAC Name: 3-[2-amino-6-chloro-N-(pyridin-3-ylmethyl)anilino]propanenitrile Traditional Name: 3-[2-amino-6-chloro-N-(3-pyridylmethyl)anilino]propionitrile Formula: C15H15ClN4 MolecularWeight: 286.7594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)N(CCC#N)CC2=CN=CC=C2)N

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)N(CCC#N)CC2=CN=CC=C2)N

InChI

InChI=1S/C15H15ClN4/c16-13-5-1-6-14(18)15(13)20(9-3-7-17)11-12-4-2-8-19-10-12/h1-2,4-6,8,10H,3,9,11,18H2