2-[4-[3,4-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[4-[3,4-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-[4-(3,4-difluorophenyl)sulfonylpiperazin-1-yl]-6-fluoro-benzonitrile CAS Name: 2-[4-(3,4-difluorophenyl)sulfonyl-1-piperazinyl]-6-fluorobenzonitrile IUPAC Name: 2-[4-(3,4-difluorophenyl)sulfonylpiperazin-1-yl]-6-fluorobenzonitrile Traditional Name: 2-[4-(3,4-difluorophenyl)sulfonylpiperazino]-6-fluoro-benzonitrile Formula: C17H14F3N3O2S MolecularWeight: 381.37217

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14F3N3O2S/c18-14-2-1-3-17(13(14)11-21)22-6-8-23(9-7-22)26(24,25)12-4-5-15(19)16(20)10-12/h1-5,10H,6-9H2