2-[4-[6-(dimethylamino)pyridin-3-yl]carbonylpiperazin-1-yl]-2-(4-fluorophenyl)ethanenitrile

Systemtic Name: 2-[4-[6-(dimethylamino)pyridin-3-yl]carbonylpiperazin-1-yl]-2-(4-fluorophenyl)ethanenitrile Openeye Name: 2-[4-[6-(dimethylamino)pyridine-3-carbonyl]piperazin-1-yl]-2-(4-fluorophenyl)acetonitrile CAS Name: 2-[4-[[6-(dimethylamino)-3-pyridinyl]-oxomethyl]-1-piperazinyl]-2-(4-fluorophenyl)acetonitrile IUPAC Name: 2-[4-[6-(dimethylamino)pyridine-3-carbonyl]piperazin-1-yl]-2-(4-fluorophenyl)acetonitrile Traditional Name: 2-[4-[6-(dimethylamino)nicotinoyl]piperazino]-2-(4-fluorophenyl)acetonitrile Formula: C20H22FN5O MolecularWeight: 367.419983

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C(C=C1)C(=O)N2CCN(CC2)C(C#N)C3=CC=C(C=C3)F

Isomeric SMILES

CN(C)C1=NC=C(C=C1)C(=O)N2CCN(CC2)C(C#N)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN5O/c1-24(2)19-8-5-16(14-23-19)20(27)26-11-9-25(10-12-26)18(13-22)15-3-6-17(21)7-4-15/h3-8,14,18H,9-12H2,1-2H3