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

Systemtic Name: 3-[(2-phenyl-6-pyridin-4-yl-pyrimidin-4-yl)amino]propanenitrile Openeye Name: 3-[[2-phenyl-6-(4-pyridyl)pyrimidin-4-yl]amino]propanenitrile CAS Name: 3-[(2-phenyl-6-pyridin-4-yl-4-pyrimidinyl)amino]propanenitrile IUPAC Name: 3-[(2-phenyl-6-pyridin-4-ylpyrimidin-4-yl)amino]propanenitrile Traditional Name: 3-[[2-phenyl-6-(4-pyridyl)pyrimidin-4-yl]amino]propionitrile Formula: C18H15N5 MolecularWeight: 301.3452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15N5/c19-9-4-10-21-17-13-16(14-7-11-20-12-8-14)22-18(23-17)15-5-2-1-3-6-15/h1-3,5-8,11-13H,4,10H2,(H,21,22,23)