2-[3,5-bis(fluoranyl)-4-(4-methylpiperazin-1-yl)pyridin-2-yl]-2-phenyl-ethanenitrile

Systemtic Name: 2-[3,5-bis(fluoranyl)-4-(4-methylpiperazin-1-yl)pyridin-2-yl]-2-phenyl-ethanenitrile Openeye Name: 2-[3,5-difluoro-4-(4-methylpiperazin-1-yl)-2-pyridyl]-2-phenyl-acetonitrile CAS Name: 2-[3,5-difluoro-4-(4-methyl-1-piperazinyl)-2-pyridinyl]-2-phenylacetonitrile IUPAC Name: 2-[3,5-difluoro-4-(4-methylpiperazin-1-yl)pyridin-2-yl]-2-phenylacetonitrile Traditional Name: 2-[3,5-difluoro-4-(4-methylpiperazino)-2-pyridyl]-2-phenyl-acetonitrile Formula: C18H18F2N4 MolecularWeight: 328.359126

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C(=NC=C2F)C(C#N)C3=CC=CC=C3)F

Isomeric SMILES

CN1CCN(CC1)C2=C(C(=NC=C2F)C(C#N)C3=CC=CC=C3)F

InChI

InChI=1S/C18H18F2N4/c1-23-7-9-24(10-8-23)18-15(19)12-22-17(16(18)20)14(11-21)13-5-3-2-4-6-13/h2-6,12,14H,7-10H2,1H3