2-fluoranyl-6-(4-pyridin-3-ylsulfonylpiperazin-1-yl)benzenecarbonitrile

Systemtic Name: 2-fluoranyl-6-(4-pyridin-3-ylsulfonylpiperazin-1-yl)benzenecarbonitrile Openeye Name: 2-fluoro-6-[4-(3-pyridylsulfonyl)piperazin-1-yl]benzonitrile CAS Name: 2-fluoro-6-[4-(3-pyridinylsulfonyl)-1-piperazinyl]benzonitrile IUPAC Name: 2-fluoro-6-(4-pyridin-3-ylsulfonylpiperazin-1-yl)benzonitrile Traditional Name: 2-fluoro-6-[4-(3-pyridylsulfonyl)piperazino]benzonitrile Formula: C16H15FN4O2S MolecularWeight: 346.379303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=CC=C2)F)C#N)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

C1CN(CCN1C2=C(C(=CC=C2)F)C#N)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C16H15FN4O2S/c17-15-4-1-5-16(14(15)11-18)20-7-9-21(10-8-20)24(22,23)13-3-2-6-19-12-13/h1-6,12H,7-10H2