3-[(6-pyridin-3-yl-2-pyridin-4-yl-pyrimidin-4-yl)amino]propanenitrile

Systemtic Name: 3-[(6-pyridin-3-yl-2-pyridin-4-yl-pyrimidin-4-yl)amino]propanenitrile Openeye Name: 3-[[6-(3-pyridyl)-2-(4-pyridyl)pyrimidin-4-yl]amino]propanenitrile CAS Name: 3-[[6-(3-pyridinyl)-2-pyridin-4-yl-4-pyrimidinyl]amino]propanenitrile IUPAC Name: 3-[(6-pyridin-3-yl-2-pyridin-4-ylpyrimidin-4-yl)amino]propanenitrile Traditional Name: 3-[[6-(3-pyridyl)-2-(4-pyridyl)pyrimidin-4-yl]amino]propionitrile Formula: C17H14N6 MolecularWeight: 302.33326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=CC(=NC(=N2)C3=CC=NC=C3)NCCC#N

Isomeric SMILES

C1=CC(=CN=C1)C2=CC(=NC(=N2)C3=CC=NC=C3)NCCC#N

InChI

InChI=1S/C17H14N6/c18-6-2-8-21-16-11-15(14-3-1-7-20-12-14)22-17(23-16)13-4-9-19-10-5-13/h1,3-5,7,9-12H,2,8H2,(H,21,22,23)