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

Systemtic Name: 3-[[2-pyridin-2-yl-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]amino]propanenitrile Openeye Name: 3-[[2-(2-pyridyl)-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]amino]propanenitrile CAS Name: 3-[[2-(2-pyridinyl)-6-[3-(trifluoromethyl)phenyl]-4-pyrimidinyl]amino]propanenitrile IUPAC Name: 3-[[2-pyridin-2-yl-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]amino]propanenitrile Traditional Name: 3-[[2-(2-pyridyl)-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]amino]propionitrile Formula: C19H14F3N5 MolecularWeight: 369.34317

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H14F3N5/c20-19(21,22)14-6-3-5-13(11-14)16-12-17(25-10-4-8-23)27-18(26-16)15-7-1-2-9-24-15/h1-3,5-7,9,11-12H,4,10H2,(H,25,26,27)