6-[4-[3,4-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 6-[4-[3,4-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-[4-(3,4-difluorophenyl)sulfonylpiperazin-1-yl]pyridine-3-carbonitrile CAS Name: 6-[4-(3,4-difluorophenyl)sulfonyl-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-(3,4-difluorophenyl)sulfonylpiperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 6-[4-(3,4-difluorophenyl)sulfonylpiperazino]nicotinonitrile Formula: C16H14F2N4O2S MolecularWeight: 364.369766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14F2N4O2S/c17-14-3-2-13(9-15(14)18)25(23,24)22-7-5-21(6-8-22)16-4-1-12(10-19)11-20-16/h1-4,9,11H,5-8H2