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

Systemtic Name: 2-(4-fluorophenyl)-2-[4-(6-methylpyridin-3-yl)carbonylpiperazin-1-yl]ethanenitrile Openeye Name: 2-(4-fluorophenyl)-2-[4-(6-methylpyridine-3-carbonyl)piperazin-1-yl]acetonitrile CAS Name: 2-(4-fluorophenyl)-2-[4-[(6-methyl-3-pyridinyl)-oxomethyl]-1-piperazinyl]acetonitrile IUPAC Name: 2-(4-fluorophenyl)-2-[4-(6-methylpyridine-3-carbonyl)piperazin-1-yl]acetonitrile Traditional Name: 2-(4-fluorophenyl)-2-[4-(6-methylnicotinoyl)piperazino]acetonitrile Formula: C19H19FN4O MolecularWeight: 338.378763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(=O)N2CCN(CC2)C(C#N)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NC=C(C=C1)C(=O)N2CCN(CC2)C(C#N)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H19FN4O/c1-14-2-3-16(13-22-14)19(25)24-10-8-23(9-11-24)18(12-21)15-4-6-17(20)7-5-15/h2-7,13,18H,8-11H2,1H3