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

Systemtic Name: 2-[4-[2,6-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-[4-(2,6-difluorophenyl)sulfonylpiperazin-1-yl]-6-fluoro-benzonitrile CAS Name: 2-[4-(2,6-difluorophenyl)sulfonyl-1-piperazinyl]-6-fluorobenzonitrile IUPAC Name: 2-[4-(2,6-difluorophenyl)sulfonylpiperazin-1-yl]-6-fluorobenzonitrile Traditional Name: 2-[4-(2,6-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=C(C=CC=C3F)F

Isomeric SMILES

C1CN(CCN1C2=C(C(=CC=C2)F)C#N)S(=O)(=O)C3=C(C=CC=C3F)F

InChI

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