2-fluoranyl-6-[4-(1-pyrazin-2-ylpiperidin-3-yl)carbonylpiperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-6-[4-(1-pyrazin-2-ylpiperidin-3-yl)carbonylpiperazin-1-yl]benzenecarbonitrile Openeye Name: 2-fluoro-6-[4-(1-pyrazin-2-ylpiperidine-3-carbonyl)piperazin-1-yl]benzonitrile CAS Name: 2-fluoro-6-[4-[oxo-[1-(2-pyrazinyl)-3-piperidinyl]methyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-fluoro-6-[4-(1-pyrazin-2-ylpiperidine-3-carbonyl)piperazin-1-yl]benzonitrile Traditional Name: 2-fluoro-6-[4-(1-pyrazin-2-ylnipecotoyl)piperazino]benzonitrile Formula: C21H23FN6O MolecularWeight: 394.445323

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CN=C2)C(=O)N3CCN(CC3)C4=C(C(=CC=C4)F)C#N

Isomeric SMILES

C1CC(CN(C1)C2=NC=CN=C2)C(=O)N3CCN(CC3)C4=C(C(=CC=C4)F)C#N

InChI

InChI=1S/C21H23FN6O/c22-18-4-1-5-19(17(18)13-23)26-9-11-27(12-10-26)21(29)16-3-2-8-28(15-16)20-14-24-6-7-25-20/h1,4-7,14,16H,2-3,8-12,15H2